2-[(4-nitrophenyl)methyl-(phenylmethyl)amino]ethyl 4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carboxylate

Systemtic Name: 2-[(4-nitrophenyl)methyl-(phenylmethyl)amino]ethyl 4-(2-oxidanylidene-3H-benzimidazol-1-yl)piperidine-1-carboxylate Openeye Name: 2-[benzyl-[(4-nitrophenyl)methyl]amino]ethyl 4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carboxylate CAS Name: 4-(2-oxo-3H-benzimidazol-1-yl)-1-piperidinecarboxylic acid 2-[(4-nitrophenyl)methyl-(phenylmethyl)amino]ethyl ester IUPAC Name: 2-[benzyl-[(4-nitrophenyl)methyl]amino]ethyl 4-(2-oxo-3H-benzimidazol-1-yl)piperidine-1-carboxylate Traditional Name: 4-(2-keto-3H-benzimidazol-1-yl)piperidine-1-carboxylic acid 2-[benzyl-(4-nitrobenzyl)amino]ethyl ester Formula: C29H31N5O5 MolecularWeight: 529.58694

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)OCCN(CC4=CC=CC=C4)CC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3NC2=O)C(=O)OCCN(CC4=CC=CC=C4)CC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H31N5O5/c35-28-30-26-8-4-5-9-27(26)33(28)24-14-16-32(17-15-24)29(36)39-19-18-31(20-22-6-2-1-3-7-22)21-23-10-12-25(13-11-23)34(37)38/h1-13,24H,14-21H2,(H,30,35)