(E)-3-methoxycarbonyl-4-(3-methylphenyl)but-3-enoic acid

Systemtic Name: (E)-3-methoxycarbonyl-4-(3-methylphenyl)but-3-enoic acid Openeye Name: (E)-3-methoxycarbonyl-4-(m-tolyl)but-3-enoic acid CAS Name: (E)-3-methoxycarbonyl-4-(3-methylphenyl)-3-butenoic acid IUPAC Name: (E)-3-methoxycarbonyl-4-(3-methylphenyl)but-3-enoic acid Traditional Name: (E)-3-carbomethoxy-4-(m-tolyl)but-3-enoic acid Formula: C13H14O4 MolecularWeight: 234.24786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O4/c1-9-4-3-5-10(6-9)7-11(8-12(14)15)13(16)17-2/h3-7H,8H2,1-2H3,(H,14,15)/b11-7+