[1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-[[(E)-2-phenylethenyl]sulfonylamino]ethanoate

Systemtic Name: [1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] 2-[[(E)-2-phenylethenyl]sulfonylamino]ethanoate Openeye Name: [2-(3,4-dimethylphenyl)-1-methyl-2-oxo-ethyl] 2-[[(E)-styryl]sulfonylamino]acetate CAS Name: 2-[[(E)-2-phenylethenyl]sulfonylamino]acetic acid [1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] 2-[[(E)-2-phenylethenyl]sulfonylamino]acetate Traditional Name: 2-[[(E)-styryl]sulfonylamino]acetic acid [2-(3,4-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)C(C)OC(=O)CNS(=O)(=O)C=CC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)C(C)OC(=O)CNS(=O)(=O)/C=C/C2=CC=CC=C2)C

InChI

InChI=1S/C21H23NO5S/c1-15-9-10-19(13-16(15)2)21(24)17(3)27-20(23)14-22-28(25,26)12-11-18-7-5-4-6-8-18/h4-13,17,22H,14H2,1-3H3/b12-11+