(E)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]but-2-en-1-one

Systemtic Name: (E)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]but-2-en-1-one Openeye Name: (E)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]but-2-en-1-one CAS Name: (E)-1-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]but-2-en-1-one Traditional Name: (E)-1-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]but-2-en-1-one Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

Isomeric SMILES

C/C=C/C(=O)N1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C16H22N2O5S/c1-4-5-16(19)17-8-10-18(11-9-17)24(20,21)13-6-7-14(22-2)15(12-13)23-3/h4-7,12H,8-11H2,1-3H3/b5-4+