4-[3-(3-cyanophenyl)-4-methoxy-phenyl]benzoic acid

Systemtic Name: 4-[3-(3-cyanophenyl)-4-methoxy-phenyl]benzoic acid Openeye Name: 4-[3-(3-cyanophenyl)-4-methoxy-phenyl]benzoic acid CAS Name: 4-[3-(3-cyanophenyl)-4-methoxyphenyl]benzoic acid IUPAC Name: 4-[3-(3-cyanophenyl)-4-methoxyphenyl]benzoic acid Traditional Name: 4-[3-(3-cyanophenyl)-4-methoxy-phenyl]benzoic acid Formula: C21H15NO3 MolecularWeight: 329.3487

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)O)C3=CC=CC(=C3)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC=C(C=C2)C(=O)O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H15NO3/c1-25-20-10-9-17(15-5-7-16(8-6-15)21(23)24)12-19(20)18-4-2-3-14(11-18)13-22/h2-12H,1H3,(H,23,24)