(3-nitrophenyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (3-nitrophenyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (4-benzyl-1,4-diazepan-1-yl)-(3-nitrophenyl)methanone CAS Name: (3-nitrophenyl)-[4-(phenylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (4-benzyl-1,4-diazepan-1-yl)-(3-nitrophenyl)methanone Traditional Name: (4-benzyl-1,4-diazepan-1-yl)-(3-nitrophenyl)methanone Formula: C19H21N3O3 MolecularWeight: 339.38834

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-])CC3=CC=CC=C3

InChI

InChI=1S/C19H21N3O3/c23-19(17-8-4-9-18(14-17)22(24)25)21-11-5-10-20(12-13-21)15-16-6-2-1-3-7-16/h1-4,6-9,14H,5,10-13,15H2