2-[(E)-3-methoxy-1-(4-methylphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzoic acid

Systemtic Name: 2-[(E)-3-methoxy-1-(4-methylphenyl)-3-oxidanylidene-prop-1-en-2-yl]benzoic acid Openeye Name: 2-[(E)-1-methoxycarbonyl-2-(p-tolyl)vinyl]benzoic acid CAS Name: 2-[(E)-3-methoxy-1-(4-methylphenyl)-3-oxoprop-1-en-2-yl]benzoic acid IUPAC Name: 2-[(E)-3-methoxy-1-(4-methylphenyl)-3-oxoprop-1-en-2-yl]benzoic acid Traditional Name: 2-[(E)-1-carbomethoxy-2-(p-tolyl)vinyl]benzoic acid Formula: C18H16O4 MolecularWeight: 296.31724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C(C2=CC=CC=C2C(=O)O)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)/C=C(\C2=CC=CC=C2C(=O)O)/C(=O)OC

InChI

InChI=1S/C18H16O4/c1-12-7-9-13(10-8-12)11-16(18(21)22-2)14-5-3-4-6-15(14)17(19)20/h3-11H,1-2H3,(H,19,20)/b16-11+