(3-chloranyl-4-oxidanyl-phenyl)-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-4-oxidanyl-phenyl)-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (3-chloro-4-hydroxy-phenyl)-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (3-chloro-4-hydroxyphenyl)-[4-(2,5-dimethylphenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (3-chloro-4-hydroxyphenyl)-[4-(2,5-dimethylphenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (3-chloro-4-hydroxy-phenyl)-[4-(2,5-dimethylphenyl)sulfonylpiperazino]methanone Formula: C19H21ClN2O4S MolecularWeight: 408.89904

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)O)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)O)Cl

InChI

InChI=1S/C19H21ClN2O4S/c1-13-3-4-14(2)18(11-13)27(25,26)22-9-7-21(8-10-22)19(24)15-5-6-17(23)16(20)12-15/h3-6,11-12,23H,7-10H2,1-2H3