2-cyano-3-[(4-methoxyphenyl)methyl]-4-methyl-benzoic acid

Systemtic Name: 2-cyano-3-[(4-methoxyphenyl)methyl]-4-methyl-benzoic acid Openeye Name: 2-cyano-3-[(4-methoxyphenyl)methyl]-4-methyl-benzoic acid CAS Name: 2-cyano-3-[(4-methoxyphenyl)methyl]-4-methylbenzoic acid IUPAC Name: 2-cyano-3-[(4-methoxyphenyl)methyl]-4-methylbenzoic acid Traditional Name: 2-cyano-4-methyl-3-p-anisyl-benzoic acid Formula: C17H15NO3 MolecularWeight: 281.3059

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C(=O)O)C#N)CC2=CC=C(C=C2)OC

Isomeric SMILES

CC1=C(C(=C(C=C1)C(=O)O)C#N)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C17H15NO3/c1-11-3-8-14(17(19)20)16(10-18)15(11)9-12-4-6-13(21-2)7-5-12/h3-8H,9H2,1-2H3,(H,19,20)