1-(3-nitrophenyl)carbonylazepan-2-one

Systemtic Name: 1-(3-nitrophenyl)carbonylazepan-2-one Openeye Name: 1-(3-nitrobenzoyl)azepan-2-one CAS Name: 1-[(3-nitrophenyl)-oxomethyl]-2-azepanone IUPAC Name: 1-(3-nitrobenzoyl)azepan-2-one Traditional Name: 1-(3-nitrobenzoyl)azepan-2-one Formula: C13H14N2O4 MolecularWeight: 262.26126

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=O)N(CC1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCC(=O)N(CC1)C(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O4/c16-12-7-2-1-3-8-14(12)13(17)10-5-4-6-11(9-10)15(18)19/h4-6,9H,1-3,7-8H2