methyl 1-(2,3-diphenylpropyl)-3-[[(phenylmethyl)amino]methyl]indole-5-carboxylate

Systemtic Name: methyl 1-(2,3-diphenylpropyl)-3-[[(phenylmethyl)amino]methyl]indole-5-carboxylate Openeye Name: methyl 3-[(benzylamino)methyl]-1-(2,3-diphenylpropyl)indole-5-carboxylate CAS Name: 1-(2,3-diphenylpropyl)-3-[[(phenylmethyl)amino]methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-[(benzylamino)methyl]-1-(2,3-diphenylpropyl)indole-5-carboxylate Traditional Name: 3-[(benzylamino)methyl]-1-(2,3-diphenylpropyl)indole-5-carboxylic acid methyl ester Formula: C33H32N2O2 MolecularWeight: 488.61938

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N(C=C2CNCC3=CC=CC=C3)CC(CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N(C=C2CNCC3=CC=CC=C3)CC(CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C33H32N2O2/c1-37-33(36)28-17-18-32-31(20-28)30(22-34-21-26-13-7-3-8-14-26)24-35(32)23-29(27-15-9-4-10-16-27)19-25-11-5-2-6-12-25/h2-18,20,24,29,34H,19,21-23H2,1H3