cyclopropyl-[2-(1,4-diazepan-1-ylcarbonyl)-4-[(4-nitrophenyl)methyl-phenethyl-amino]pyrrolidin-1-yl]methanone

Systemtic Name: cyclopropyl-[2-(1,4-diazepan-1-ylcarbonyl)-4-[(4-nitrophenyl)methyl-phenethyl-amino]pyrrolidin-1-yl]methanone Openeye Name: cyclopropyl-[2-(1,4-diazepane-1-carbonyl)-4-[(4-nitrophenyl)methyl-phenethyl-amino]pyrrolidin-1-yl]methanone CAS Name: cyclopropyl-[2-[1,4-diazepan-1-yl(oxo)methyl]-4-[(4-nitrophenyl)methyl-phenethylamino]-1-pyrrolidinyl]methanone IUPAC Name: cyclopropyl-[2-(1,4-diazepane-1-carbonyl)-4-[(4-nitrophenyl)methyl-phenethylamino]pyrrolidin-1-yl]methanone Traditional Name: cyclopropyl-[2-(1,4-diazepane-1-carbonyl)-4-[(4-nitrobenzyl)-phenethyl-amino]pyrrolidino]methanone Formula: C29H37N5O4 MolecularWeight: 519.63518

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C2CC(CN2C(=O)C3CC3)N(CCC4=CC=CC=C4)CC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CNCCN(C1)C(=O)C2CC(CN2C(=O)C3CC3)N(CCC4=CC=CC=C4)CC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C29H37N5O4/c35-28(24-9-10-24)33-21-26(19-27(33)29(36)31-16-4-14-30-15-18-31)32(17-13-22-5-2-1-3-6-22)20-23-7-11-25(12-8-23)34(37)38/h1-3,5-8,11-12,24,26-27,30H,4,9-10,13-21H2