methyl (E)-3-(3,5-dimethylphenyl)but-2-enoate

Systemtic Name: methyl (E)-3-(3,5-dimethylphenyl)but-2-enoate Openeye Name: methyl (E)-3-(3,5-dimethylphenyl)but-2-enoate CAS Name: (E)-3-(3,5-dimethylphenyl)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-(3,5-dimethylphenyl)but-2-enoate Traditional Name: (E)-3-(3,5-dimethylphenyl)but-2-enoic acid methyl ester Formula: C13H16O2 MolecularWeight: 204.26494

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H16O2/c1-9-5-10(2)7-12(6-9)11(3)8-13(14)15-4/h5-8H,1-4H3/b11-8+