(3-chloranyl-4,5-dimethoxy-phenyl)-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: (3-chloranyl-4,5-dimethoxy-phenyl)-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: (3-chloro-4,5-dimethoxy-phenyl)-[4-[(E)-styryl]sulfonylpiperazin-1-yl]methanone CAS Name: (3-chloro-4,5-dimethoxyphenyl)-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: (3-chloro-4,5-dimethoxyphenyl)-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: (3-chloro-4,5-dimethoxy-phenyl)-[4-[(E)-styryl]sulfonylpiperazino]methanone Formula: C21H23ClN2O5S MolecularWeight: 450.93572

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C(=O)N2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3)Cl)OC

InChI

InChI=1S/C21H23ClN2O5S/c1-28-19-15-17(14-18(22)20(19)29-2)21(25)23-9-11-24(12-10-23)30(26,27)13-8-16-6-4-3-5-7-16/h3-8,13-15H,9-12H2,1-2H3/b13-8+