[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-[4-(methylamino)-3-nitro-phenyl]methanone

Systemtic Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-[4-(methylamino)-3-nitro-phenyl]methanone Openeye Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-[4-(methylamino)-3-nitro-phenyl]methanone CAS Name: [4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-[4-(methylamino)-3-nitrophenyl]methanone IUPAC Name: [4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-[4-(methylamino)-3-nitrophenyl]methanone Traditional Name: [4-(4-chlorophenyl)sulfonylpiperazino]-[4-(methylamino)-3-nitro-phenyl]methanone Formula: C18H19ClN4O5S MolecularWeight: 438.88526

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H19ClN4O5S/c1-20-16-7-2-13(12-17(16)23(25)26)18(24)21-8-10-22(11-9-21)29(27,28)15-5-3-14(19)4-6-15/h2-7,12,20H,8-11H2,1H3