2-[4-(4-chloranyl-2-nitro-phenyl)carbonyl-1,4-diazepan-1-yl]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[4-(4-chloranyl-2-nitro-phenyl)carbonyl-1,4-diazepan-1-yl]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-(4-chloro-2-nitro-benzoyl)-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide CAS Name: 2-[4-[(4-chloro-2-nitrophenyl)-oxomethyl]-1,4-diazepan-1-yl]-N,N-dimethylacetamide IUPAC Name: 2-[4-(4-chloro-2-nitrobenzoyl)-1,4-diazepan-1-yl]-N,N-dimethylacetamide Traditional Name: 2-[4-(4-chloro-2-nitro-benzoyl)-1,4-diazepan-1-yl]-N,N-dimethyl-acetamide Formula: C16H21ClN4O4 MolecularWeight: 368.81534

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)CN1CCCN(CC1)C(=O)C2=C(C=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H21ClN4O4/c1-18(2)15(22)11-19-6-3-7-20(9-8-19)16(23)13-5-4-12(17)10-14(13)21(24)25/h4-5,10H,3,6-9,11H2,1-2H3