1-(1,4-diazepan-1-yl)-2-(4-nitrophenyl)ethanone

Systemtic Name: 1-(1,4-diazepan-1-yl)-2-(4-nitrophenyl)ethanone Openeye Name: 1-(1,4-diazepan-1-yl)-2-(4-nitrophenyl)ethanone CAS Name: 1-(1,4-diazepan-1-yl)-2-(4-nitrophenyl)ethanone IUPAC Name: 1-(1,4-diazepan-1-yl)-2-(4-nitrophenyl)ethanone Traditional Name: 1-(1,4-diazepan-1-yl)-2-(4-nitrophenyl)ethanone Formula: C13H17N3O3 MolecularWeight: 263.29238

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1CNCCN(C1)C(=O)CC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H17N3O3/c17-13(15-8-1-6-14-7-9-15)10-11-2-4-12(5-3-11)16(18)19/h2-5,14H,1,6-10H2