N-(2-chlorophenyl)-3-nitro-4-(3-oxidanylidenepiperazin-1-yl)benzenesulfonamide

Systemtic Name: N-(2-chlorophenyl)-3-nitro-4-(3-oxidanylidenepiperazin-1-yl)benzenesulfonamide Openeye Name: N-(2-chlorophenyl)-3-nitro-4-(3-oxopiperazin-1-yl)benzenesulfonamide CAS Name: N-(2-chlorophenyl)-3-nitro-4-(3-oxo-1-piperazinyl)benzenesulfonamide IUPAC Name: N-(2-chlorophenyl)-3-nitro-4-(3-oxopiperazin-1-yl)benzenesulfonamide Traditional Name: N-(2-chlorophenyl)-4-(3-ketopiperazino)-3-nitro-benzenesulfonamide Formula: C16H15ClN4O5S MolecularWeight: 410.8321

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC(=O)N1)C2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H15ClN4O5S/c17-12-3-1-2-4-13(12)19-27(25,26)11-5-6-14(15(9-11)21(23)24)20-8-7-18-16(22)10-20/h1-6,9,19H,7-8,10H2,(H,18,22)