1-[4-[(3-nitrophenyl)methyl]-1,4-diazepan-1-yl]-2,2-diphenyl-ethanone

Systemtic Name: 1-[4-[(3-nitrophenyl)methyl]-1,4-diazepan-1-yl]-2,2-diphenyl-ethanone Openeye Name: 1-[4-[(3-nitrophenyl)methyl]-1,4-diazepan-1-yl]-2,2-diphenyl-ethanone CAS Name: 1-[4-[(3-nitrophenyl)methyl]-1,4-diazepan-1-yl]-2,2-diphenylethanone IUPAC Name: 1-[4-[(3-nitrophenyl)methyl]-1,4-diazepan-1-yl]-2,2-diphenylethanone Traditional Name: 1-[4-(3-nitrobenzyl)-1,4-diazepan-1-yl]-2,2-diphenyl-ethanone Formula: C26H27N3O3 MolecularWeight: 429.51088

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)CC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN(C1)C(=O)C(C2=CC=CC=C2)C3=CC=CC=C3)CC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H27N3O3/c30-26(25(22-10-3-1-4-11-22)23-12-5-2-6-13-23)28-16-8-15-27(17-18-28)20-21-9-7-14-24(19-21)29(31)32/h1-7,9-14,19,25H,8,15-18,20H2