(4-chloranyl-2-nitro-phenyl)-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (4-chloranyl-2-nitro-phenyl)-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (4-chloro-2-nitro-phenyl)-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (4-chloro-2-nitrophenyl)-[4-(2,5-dimethoxyphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-chloro-2-nitrophenyl)-[4-(2,5-dimethoxyphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (4-chloro-2-nitro-phenyl)-[4-(2,5-dimethoxyphenyl)sulfonylpiperazino]methanone Formula: C19H20ClN3O7S MolecularWeight: 469.896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCN(CC2)C(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H20ClN3O7S/c1-29-14-4-6-17(30-2)18(12-14)31(27,28)22-9-7-21(8-10-22)19(24)15-5-3-13(20)11-16(15)23(25)26/h3-6,11-12H,7-10H2,1-2H3