4-[[1-(diphenylmethyl)-5-methyl-indol-3-yl]methyl]-3-methoxy-benzoic acid

Systemtic Name: 4-[[1-(diphenylmethyl)-5-methyl-indol-3-yl]methyl]-3-methoxy-benzoic acid Openeye Name: 4-[(1-benzhydryl-5-methyl-indol-3-yl)methyl]-3-methoxy-benzoic acid CAS Name: 4-[[1-(diphenylmethyl)-5-methyl-3-indolyl]methyl]-3-methoxybenzoic acid IUPAC Name: 4-[(1-benzhydryl-5-methylindol-3-yl)methyl]-3-methoxybenzoic acid Traditional Name: 4-[(1-benzhydryl-5-methyl-indol-3-yl)methyl]-3-methoxy-benzoic acid Formula: C31H27NO3 MolecularWeight: 461.55098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)O)OC)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC2=C(C=C1)N(C=C2CC3=C(C=C(C=C3)C(=O)O)OC)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C31H27NO3/c1-21-13-16-28-27(17-21)26(18-24-14-15-25(31(33)34)19-29(24)35-2)20-32(28)30(22-9-5-3-6-10-22)23-11-7-4-8-12-23/h3-17,19-20,30H,18H2,1-2H3,(H,33,34)