[2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl] butanoate

Systemtic Name: [2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxidanylidene-ethyl] butanoate Openeye Name: [2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxo-ethyl] butanoate CAS Name: butanoic acid [2-[4-(3,4-dimethoxyphenyl)sulfonyl-1-piperazinyl]-2-oxoethyl] ester IUPAC Name: [2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazin-1-yl]-2-oxoethyl] butanoate Traditional Name: butyric acid [2-[4-(3,4-dimethoxyphenyl)sulfonylpiperazino]-2-keto-ethyl] ester Formula: C18H26N2O7S MolecularWeight: 414.47324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26N2O7S/c1-4-5-18(22)27-13-17(21)19-8-10-20(11-9-19)28(23,24)14-6-7-15(25-2)16(12-14)26-3/h6-7,12H,4-5,8-11,13H2,1-3H3