N-[3-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]carbonylphenyl]propane-1-sulfonamide

Systemtic Name: N-[3-[4-(4-chloranyl-2-nitro-phenyl)piperazin-1-yl]carbonylphenyl]propane-1-sulfonamide Openeye Name: N-[3-[4-(4-chloro-2-nitro-phenyl)piperazine-1-carbonyl]phenyl]propane-1-sulfonamide CAS Name: N-[3-[[4-(4-chloro-2-nitrophenyl)-1-piperazinyl]-oxomethyl]phenyl]-1-propanesulfonamide IUPAC Name: N-[3-[4-(4-chloro-2-nitrophenyl)piperazine-1-carbonyl]phenyl]propane-1-sulfonamide Traditional Name: N-[3-[4-(4-chloro-2-nitro-phenyl)piperazine-1-carbonyl]phenyl]propane-1-sulfonamide Formula: C20H23ClN4O5S MolecularWeight: 466.93842

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)NC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCS(=O)(=O)NC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H23ClN4O5S/c1-2-12-31(29,30)22-17-5-3-4-15(13-17)20(26)24-10-8-23(9-11-24)18-7-6-16(21)14-19(18)25(27)28/h3-7,13-14,22H,2,8-12H2,1H3