1-[(4-Chlorophenyl)methyl]-3-(3,3-dimethyl-1-oxobutyl)-α,α-dimethyl-5-(2-quinolinylmethoxy)-1H-indole-2-propanoic acid

CAS Registry Number®

136668-50-3

CAS Name

1-[(4-Chlorophenyl)methyl]-3-(3,3-dimethyl-1-oxobutyl)-α,α-dimethyl-5-(2-quinolinylmethoxy)-1H-indole-2-propanoic acid

Molecular Formula

C36H37ClN2O4

Molecular Mass

597.14

Cite this Page

1-[(4-Chlorophenyl)methyl]-3-(3,3-dimethyl-1-oxobutyl)-α,α-dimethyl-5-(2-quinolinylmethoxy)-1H-indole-2-propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=136668-50-3 (retrieved 2024-11-25) (CAS RN: 136668-50-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C36H37ClN2O4/c1-35(2,3)20-32(40)33-28-18-27(43-22-26-15-12-24-8-6-7-9-29(24)38-26)16-17-30(28)39(21-23-10-13-25(37)14-11-23)31(33)19-36(4,5)34(41)42/h6-18H,19-22H2,1-5H3,(H,41,42)

InChIKey

InChIKey=IUHIISLXVJPCRU-UHFFFAOYSA-N

SMILES

C(CC(C)(C)C)(=O)C=1C=2C(N(CC3=CC=C(Cl)C=C3)C1CC(C(O)=O)(C)C)=CC=C(OCC4=NC5=C(C=C4)C=CC=C5)C2

Canonical SMILES

O=C(O)C(C)(C)CC1=C(C(=O)CC(C)(C)C)C=2C=C(OCC3=NC=4C=CC=CC4C=C3)C=CC2N1CC5=CC=C(Cl)C=C5

Other Names for this Substance

  • 1H-Indole-2-propanoic acid, 1-[(4-chlorophenyl)methyl]-3-(3,3-dimethyl-1-oxobutyl)-α,α-dimethyl-5-(2-quinolinylmethoxy)-
  • 1-[(4-Chlorophenyl)methyl]-3-(3,3-dimethyl-1-oxobutyl)-α,α-dimethyl-5-(2-quinolinylmethoxy)-1H-indole-2-propanoic acid
  • L 689037

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