methyl 1-(4-methyl-2-phenyl-pentyl)-3-[[(phenylmethyl)amino]methyl]indole-5-carboxylate

Systemtic Name: methyl 1-(4-methyl-2-phenyl-pentyl)-3-[[(phenylmethyl)amino]methyl]indole-5-carboxylate Openeye Name: methyl 3-[(benzylamino)methyl]-1-(4-methyl-2-phenyl-pentyl)indole-5-carboxylate CAS Name: 1-(4-methyl-2-phenylpentyl)-3-[[(phenylmethyl)amino]methyl]-5-indolecarboxylic acid methyl ester IUPAC Name: methyl 3-[(benzylamino)methyl]-1-(4-methyl-2-phenylpentyl)indole-5-carboxylate Traditional Name: 3-[(benzylamino)methyl]-1-(4-methyl-2-phenyl-pentyl)indole-5-carboxylic acid methyl ester Formula: C30H34N2O2 MolecularWeight: 454.60316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC(CN1C=C(C2=C1C=CC(=C2)C(=O)OC)CNCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C30H34N2O2/c1-22(2)16-26(24-12-8-5-9-13-24)20-32-21-27(19-31-18-23-10-6-4-7-11-23)28-17-25(30(33)34-3)14-15-29(28)32/h4-15,17,21-22,26,31H,16,18-20H2,1-3H3