2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enyl]benzoic acid

Systemtic Name: 2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enyl]benzoic acid Openeye Name: 2-[(E)-3-(3,4-dimethoxyphenyl)allyl]benzoic acid CAS Name: 2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enyl]benzoic acid IUPAC Name: 2-[(E)-3-(3,4-dimethoxyphenyl)prop-2-enyl]benzoic acid Traditional Name: 2-[(E)-3-(3,4-dimethoxyphenyl)allyl]benzoic acid Formula: C18H18O4 MolecularWeight: 298.33312

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=CCC2=CC=CC=C2C(=O)O)OC

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/CC2=CC=CC=C2C(=O)O)OC

InChI

InChI=1S/C18H18O4/c1-21-16-11-10-13(12-17(16)22-2)6-5-8-14-7-3-4-9-15(14)18(19)20/h3-7,9-12H,8H2,1-2H3,(H,19,20)/b6-5+