Methyl 4-(di-1H-indol-3-ylmethyl)benzoate

CAS Registry Number®

151358-48-4
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CAS Name

Methyl 4-(di-1H-indol-3-ylmethyl)benzoate

Molecular Formula

C25H20N2O2

Molecular Mass

380.44

Cite this Page

Methyl 4-(di-1H-indol-3-ylmethyl)benzoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=151358-48-4 (retrieved 2024-09-10) (CAS RN: 151358-48-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    98-100 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C25H20N2O2/c1-29-25(28)17-12-10-16(11-13-17)24(20-14-26-22-8-4-2-6-18(20)22)21-15-27-23-9-5-3-7-19(21)23/h2-15,24,26-27H,1H3

InChIKey

InChIKey=BBAOKSZCULLDIW-UHFFFAOYSA-N

SMILES

C(C=1C=2C(NC1)=CC=CC2)(C=3C=4C(NC3)=CC=CC4)C5=CC=C(C(OC)=O)C=C5

Canonical SMILES

O=C(OC)C1=CC=C(C=C1)C(C2=CNC=3C=CC=CC32)C4=CNC=5C=CC=CC54

Other Names for this Substance

  • Benzoic acid, 4-(di-1H-indol-3-ylmethyl)-, methyl ester
  • Methyl 4-(di-1H-indol-3-ylmethyl)benzoate