N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]-3-nitro-benzamide Openeye Name: N-[2-(azepan-1-yl)-2-oxo-ethyl]-3-nitro-benzamide CAS Name: N-[2-(1-azepanyl)-2-oxoethyl]-3-nitrobenzamide IUPAC Name: N-[2-(azepan-1-yl)-2-oxoethyl]-3-nitrobenzamide Traditional Name: N-[2-(azepan-1-yl)-2-keto-ethyl]-3-nitro-benzamide Formula: C15H19N3O4 MolecularWeight: 305.32906

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)C(=O)CNC(=O)C2=CC(=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H19N3O4/c19-14(17-8-3-1-2-4-9-17)11-16-15(20)12-6-5-7-13(10-12)18(21)22/h5-7,10H,1-4,8-9,11H2,(H,16,20)