5-[(3-Carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[4-(diethylamino)phenyl]methyl]-2-hydroxy-3-methylbenzoic acid

CAS Registry Number®

7452-51-9

CAS Name

5-[(3-Carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[4-(diethylamino)phenyl]methyl]-2-hydroxy-3-methylbenzoic acid

Molecular Formula

C27H27NO6

Molecular Mass

461.51

Cite this Page

5-[(3-Carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[4-(diethylamino)phenyl]methyl]-2-hydroxy-3-methylbenzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=7452-51-9 (retrieved 2024-11-22) (CAS RN: 7452-51-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C27H27NO6/c1-5-28(6-2)20-9-7-17(8-10-20)23(18-11-15(3)24(29)21(13-18)26(31)32)19-12-16(4)25(30)22(14-19)27(33)34/h7-14,29H,5-6H2,1-4H3,(H,31,32)(H,33,34)

InChIKey

InChIKey=MHXLUBGHVIPIGK-UHFFFAOYSA-N

SMILES

C(C1=CC(C(O)=O)=C(O)C(C)=C1)(=C2C=C(C(O)=O)C(=O)C(C)=C2)C3=CC=C(N(CC)CC)C=C3

Canonical SMILES

O=C(O)C1=CC(C=C(C1=O)C)=C(C2=CC=C(C=C2)N(CC)CC)C=3C=C(C(=O)O)C(O)=C(C3)C

Other Names for this Substance

  • Benzoic acid, 5-[(3-carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[4-(diethylamino)phenyl]methyl]-2-hydroxy-3-methyl-
  • C.I. Mordant Violet 1
  • 5-[(3-Carboxy-5-methyl-4-oxo-2,5-cyclohexadien-1-ylidene)[4-(diethylamino)phenyl]methyl]-2-hydroxy-3-methylbenzoic acid
  • C.I. 43565
  • Brilliant Monochrome Violet 2B

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