3-(4-methylphenyl)carbonylbut-3-enoic acid

Systemtic Name: 3-(4-methylphenyl)carbonylbut-3-enoic acid Openeye Name: 3-(4-methylbenzoyl)but-3-enoic acid CAS Name: 3-[(4-methylphenyl)-oxomethyl]-3-butenoic acid IUPAC Name: 3-(4-methylbenzoyl)but-3-enoic acid Traditional Name: 3-p-toluoylbut-3-enoic acid Formula: C12H12O3 MolecularWeight: 204.22188

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12O3/c1-8-3-5-10(6-4-8)12(15)9(2)7-11(13)14/h3-6H,2,7H2,1H3,(H,13,14)