4-(dimethylamino)-3-nitro-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzamide

Systemtic Name: 4-(dimethylamino)-3-nitro-N-[3-(2-oxidanylideneazepan-1-yl)propyl]benzamide Openeye Name: 4-(dimethylamino)-3-nitro-N-[3-(2-oxoazepan-1-yl)propyl]benzamide CAS Name: 4-(dimethylamino)-3-nitro-N-[3-(2-oxo-1-azepanyl)propyl]benzamide IUPAC Name: 4-(dimethylamino)-3-nitro-N-[3-(2-oxoazepan-1-yl)propyl]benzamide Traditional Name: 4-(dimethylamino)-N-[3-(2-ketoazepan-1-yl)propyl]-3-nitro-benzamide Formula: C18H26N4O4 MolecularWeight: 362.42344

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)C(=O)NCCCN2CCCCCC2=O)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)C(=O)NCCCN2CCCCCC2=O)[N+](=O)[O-]

InChI

InChI=1S/C18H26N4O4/c1-20(2)15-9-8-14(13-16(15)22(25)26)18(24)19-10-6-12-21-11-5-3-4-7-17(21)23/h8-9,13H,3-7,10-12H2,1-2H3,(H,19,24)