1-[3-nitro-4-[(2-oxidanylideneazepan-3-yl)amino]phenyl]piperidine-2,6-dione

Systemtic Name: 1-[3-nitro-4-[(2-oxidanylideneazepan-3-yl)amino]phenyl]piperidine-2,6-dione Openeye Name: 1-[3-nitro-4-[(2-oxoazepan-3-yl)amino]phenyl]piperidine-2,6-dione CAS Name: 1-[3-nitro-4-[(2-oxo-3-azepanyl)amino]phenyl]piperidine-2,6-dione IUPAC Name: 1-[3-nitro-4-[(2-oxoazepan-3-yl)amino]phenyl]piperidine-2,6-dione Traditional Name: 1-[4-[(2-ketoazepan-3-yl)amino]-3-nitro-phenyl]piperidine-2,6-quinone Formula: C17H20N4O5 MolecularWeight: 360.3645

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC2=C(C=C(C=C2)N3C(=O)CCCC3=O)[N+](=O)[O-]

Isomeric SMILES

C1CCNC(=O)C(C1)NC2=C(C=C(C=C2)N3C(=O)CCCC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H20N4O5/c22-15-5-3-6-16(23)20(15)11-7-8-12(14(10-11)21(25)26)19-13-4-1-2-9-18-17(13)24/h7-8,10,13,19H,1-6,9H2,(H,18,24)