[(2S)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] (E)-3-(4-methoxyphenyl)prop-2-enoate

Systemtic Name: [(2S)-1-(2,5-dimethylphenyl)-1-oxidanylidene-propan-2-yl] (E)-3-(4-methoxyphenyl)prop-2-enoate Openeye Name: [(1S)-2-(2,5-dimethylphenyl)-1-methyl-2-oxo-ethyl] (E)-3-(4-methoxyphenyl)prop-2-enoate CAS Name: (E)-3-(4-methoxyphenyl)-2-propenoic acid [(2S)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(2,5-dimethylphenyl)-1-oxopropan-2-yl] (E)-3-(4-methoxyphenyl)prop-2-enoate Traditional Name: (E)-3-(4-methoxyphenyl)acrylic acid [(1S)-2-(2,5-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H22O4 MolecularWeight: 338.39698

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC(=C(C=C1)C)C(=O)[C@H](C)OC(=O)/C=C/C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H22O4/c1-14-5-6-15(2)19(13-14)21(23)16(3)25-20(22)12-9-17-7-10-18(24-4)11-8-17/h5-13,16H,1-4H3/b12-9+/t16-/m0/s1