4-chloranyl-N-[4-(4-ethanoylpiperazin-1-yl)carbonylphenyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[4-(4-ethanoylpiperazin-1-yl)carbonylphenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[4-(4-acetylpiperazine-1-carbonyl)phenyl]-4-chloro-3-nitro-benzenesulfonamide CAS Name: N-[4-[(4-acetyl-1-piperazinyl)-oxomethyl]phenyl]-4-chloro-3-nitrobenzenesulfonamide IUPAC Name: N-[4-(4-acetylpiperazine-1-carbonyl)phenyl]-4-chloro-3-nitrobenzenesulfonamide Traditional Name: N-[4-(4-acetylpiperazine-1-carbonyl)phenyl]-4-chloro-3-nitro-benzenesulfonamide Formula: C19H19ClN4O6S MolecularWeight: 466.89536

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H19ClN4O6S/c1-13(25)22-8-10-23(11-9-22)19(26)14-2-4-15(5-3-14)21-31(29,30)16-6-7-17(20)18(12-16)24(27)28/h2-7,12,21H,8-11H2,1H3