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

Systemtic Name: 1,4-diazepan-1-yl-[1-(4-fluorophenyl)carbonyl-4-[(4-nitrophenyl)methyl-phenethyl-amino]pyrrolidin-2-yl]methanone Openeye Name: 1,4-diazepan-1-yl-[1-(4-fluorobenzoyl)-4-[(4-nitrophenyl)methyl-phenethyl-amino]pyrrolidin-2-yl]methanone CAS Name: 1,4-diazepan-1-yl-[1-[(4-fluorophenyl)-oxomethyl]-4-[(4-nitrophenyl)methyl-phenethylamino]-2-pyrrolidinyl]methanone IUPAC Name: 1,4-diazepan-1-yl-[1-(4-fluorobenzoyl)-4-[(4-nitrophenyl)methyl-phenethylamino]pyrrolidin-2-yl]methanone Traditional Name: 1,4-diazepan-1-yl-[1-(4-fluorobenzoyl)-4-[(4-nitrobenzyl)-phenethyl-amino]pyrrolidin-2-yl]methanone Formula: C32H36FN5O4 MolecularWeight: 573.657743

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C2CC(CN2C(=O)C3=CC=C(C=C3)F)N(CCC4=CC=CC=C4)CC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CNCCN(C1)C(=O)C2CC(CN2C(=O)C3=CC=C(C=C3)F)N(CCC4=CC=CC=C4)CC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C32H36FN5O4/c33-27-11-9-26(10-12-27)31(39)37-23-29(21-30(37)32(40)35-18-4-16-34-17-20-35)36(19-15-24-5-2-1-3-6-24)22-25-7-13-28(14-8-25)38(41)42/h1-3,5-14,29-30,34H,4,15-23H2