methyl 1-[2-(2-hydroxyphenyl)-3-phenyl-propyl]-3-(phenylazanylmethyl)indole-5-carboxylate

Systemtic Name: methyl 1-[2-(2-hydroxyphenyl)-3-phenyl-propyl]-3-(phenylazanylmethyl)indole-5-carboxylate Openeye Name: methyl 3-(anilinomethyl)-1-[2-(2-hydroxyphenyl)-3-phenyl-propyl]indole-5-carboxylate CAS Name: 3-(anilinomethyl)-1-[2-(2-hydroxyphenyl)-3-phenylpropyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-(anilinomethyl)-1-[2-(2-hydroxyphenyl)-3-phenylpropyl]indole-5-carboxylate Traditional Name: 3-(anilinomethyl)-1-[2-(2-hydroxyphenyl)-3-phenyl-propyl]indole-5-carboxylic acid methyl ester Formula: C32H30N2O3 MolecularWeight: 490.5922

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C=C2CNC3=CC=CC=C3)CC(CC4=CC=CC=C4)C5=CC=CC=C5O

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C=C2CNC3=CC=CC=C3)CC(CC4=CC=CC=C4)C5=CC=CC=C5O

InChI

InChI=1S/C32H30N2O3/c1-37-32(36)24-16-17-30-29(19-24)26(20-33-27-12-6-3-7-13-27)22-34(30)21-25(18-23-10-4-2-5-11-23)28-14-8-9-15-31(28)35/h2-17,19,22,25,33,35H,18,20-21H2,1H3