[(2R)-1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] (E)-3-(4-methylphenyl)prop-2-enoate

Systemtic Name: [(2R)-1-(3,4-dimethylphenyl)-1-oxidanylidene-propan-2-yl] (E)-3-(4-methylphenyl)prop-2-enoate Openeye Name: [(1R)-2-(3,4-dimethylphenyl)-1-methyl-2-oxo-ethyl] (E)-3-(p-tolyl)prop-2-enoate CAS Name: (E)-3-(4-methylphenyl)-2-propenoic acid [(2R)-1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(3,4-dimethylphenyl)-1-oxopropan-2-yl] (E)-3-(4-methylphenyl)prop-2-enoate Traditional Name: (E)-3-(p-tolyl)acrylic acid [(1R)-2-(3,4-dimethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22O3/c1-14-5-8-18(9-6-14)10-12-20(22)24-17(4)21(23)19-11-7-15(2)16(3)13-19/h5-13,17H,1-4H3/b12-10+/t17-/m1/s1