methyl 6-azanyl-2-[[2-(4-phenylphenyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-3-yl]carbonylamino]hexanoate

Systemtic Name: methyl 6-azanyl-2-[[2-(4-phenylphenyl)carbonyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-3-yl]carbonylamino]hexanoate Openeye Name: methyl 6-amino-2-[[2-(4-phenylbenzoyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carbonyl]amino]hexanoate CAS Name: 6-amino-2-[[oxo-[2-[oxo-(4-phenylphenyl)methyl]-1,3,4,9-tetrahydropyrido[3,4-b]indol-3-yl]methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-amino-2-[[2-(4-phenylbenzoyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-3-carbonyl]amino]hexanoate Traditional Name: 6-amino-2-[[2-(4-phenylbenzoyl)-1,3,4,9-tetrahydro-$b-carboline-3-carbonyl]amino]hexanoic acid methyl ester Formula: C32H34N4O4 MolecularWeight: 538.63676

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CCCCN)NC(=O)C1CC2=C(CN1C(=O)C3=CC=C(C=C3)C4=CC=CC=C4)NC5=CC=CC=C25

Isomeric SMILES

COC(=O)C(CCCCN)NC(=O)C1CC2=C(CN1C(=O)C3=CC=C(C=C3)C4=CC=CC=C4)NC5=CC=CC=C25

InChI

InChI=1S/C32H34N4O4/c1-40-32(39)27(13-7-8-18-33)35-30(37)29-19-25-24-11-5-6-12-26(24)34-28(25)20-36(29)31(38)23-16-14-22(15-17-23)21-9-3-2-4-10-21/h2-6,9-12,14-17,27,29,34H,7-8,13,18-20,33H2,1H3,(H,35,37)