2-[[4-(azepan-1-ylsulfonyl)-2-nitro-phenyl]amino]-N,N-dimethyl-ethanamide

Systemtic Name: 2-[[4-(azepan-1-ylsulfonyl)-2-nitro-phenyl]amino]-N,N-dimethyl-ethanamide Openeye Name: 2-[4-(azepan-1-ylsulfonyl)-2-nitro-anilino]-N,N-dimethyl-acetamide CAS Name: 2-[4-(1-azepanylsulfonyl)-2-nitroanilino]-N,N-dimethylacetamide IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)-2-nitroanilino]-N,N-dimethylacetamide Traditional Name: 2-[4-(azepan-1-ylsulfonyl)-2-nitro-anilino]-N,N-dimethyl-acetamide Formula: C16H24N4O5S MolecularWeight: 384.45056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)CNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H24N4O5S/c1-18(2)16(21)12-17-14-8-7-13(11-15(14)20(22)23)26(24,25)19-9-5-3-4-6-10-19/h7-8,11,17H,3-6,9-10,12H2,1-2H3