3-(2-nitrophenyl)carbonylazepan-2-one

Systemtic Name: 3-(2-nitrophenyl)carbonylazepan-2-one Openeye Name: 3-(2-nitrobenzoyl)azepan-2-one CAS Name: 3-[(2-nitrophenyl)-oxomethyl]-2-azepanone IUPAC Name: 3-(2-nitrobenzoyl)azepan-2-one Traditional Name: 3-(2-nitrobenzoyl)azepan-2-one Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)C(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

C1CCNC(=O)C(C1)C(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O4/c16-12(10-6-3-4-8-14-13(10)17)9-5-1-2-7-11(9)15(18)19/h1-2,5,7,10H,3-4,6,8H2,(H,14,17)