[1-(4-tert-butylphenyl)-1-oxidanylidene-propan-2-yl] (E)-3-(3,4-dichlorophenyl)prop-2-enoate

Systemtic Name: [1-(4-tert-butylphenyl)-1-oxidanylidene-propan-2-yl] (E)-3-(3,4-dichlorophenyl)prop-2-enoate Openeye Name: [2-(4-tert-butylphenyl)-1-methyl-2-oxo-ethyl] (E)-3-(3,4-dichlorophenyl)prop-2-enoate CAS Name: (E)-3-(3,4-dichlorophenyl)-2-propenoic acid [1-(4-tert-butylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-tert-butylphenyl)-1-oxopropan-2-yl] (E)-3-(3,4-dichlorophenyl)prop-2-enoate Traditional Name: (E)-3-(3,4-dichlorophenyl)acrylic acid [2-(4-tert-butylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C22H22Cl2O3 MolecularWeight: 405.31428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)C(C)(C)C)OC(=O)/C=C/C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C22H22Cl2O3/c1-14(21(26)16-7-9-17(10-8-16)22(2,3)4)27-20(25)12-6-15-5-11-18(23)19(24)13-15/h5-14H,1-4H3/b12-6+