[2-oxidanylidene-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethyl] (1S)-cyclohex-3-ene-1-carboxylate

Systemtic Name: [2-oxidanylidene-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethyl] (1S)-cyclohex-3-ene-1-carboxylate Openeye Name: [2-oxo-2-[4-[(E)-styryl]sulfonylpiperazin-1-yl]ethyl] (1S)-cyclohex-3-ene-1-carboxylate CAS Name: (1S)-1-cyclohex-3-enecarboxylic acid [2-oxo-2-[4-[(E)-2-phenylethenyl]sulfonyl-1-piperazinyl]ethyl] ester IUPAC Name: [2-oxo-2-[4-[(E)-2-phenylethenyl]sulfonylpiperazin-1-yl]ethyl] (1S)-cyclohex-3-ene-1-carboxylate Traditional Name: (1S)-cyclohex-3-ene-1-carboxylic acid [2-keto-2-[4-[(E)-styryl]sulfonylpiperazino]ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1)C(=O)OCC(=O)N2CCN(CC2)S(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

C1C[C@@H](CC=C1)C(=O)OCC(=O)N2CCN(CC2)S(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O5S/c24-20(17-28-21(25)19-9-5-2-6-10-19)22-12-14-23(15-13-22)29(26,27)16-11-18-7-3-1-4-8-18/h1-5,7-8,11,16,19H,6,9-10,12-15,17H2/b16-11+/t19-/m1/s1