2-[(3-cyanophenyl)amino]-3-[4-(2,6-dimethoxyphenyl)phenyl]propanoic acid

Systemtic Name: 2-[(3-cyanophenyl)amino]-3-[4-(2,6-dimethoxyphenyl)phenyl]propanoic acid Openeye Name: 2-(3-cyanoanilino)-3-[4-(2,6-dimethoxyphenyl)phenyl]propanoic acid CAS Name: 2-(3-cyanoanilino)-3-[4-(2,6-dimethoxyphenyl)phenyl]propanoic acid IUPAC Name: 2-(3-cyanoanilino)-3-[4-(2,6-dimethoxyphenyl)phenyl]propanoic acid Traditional Name: 2-(3-cyanoanilino)-3-[4-(2,6-dimethoxyphenyl)phenyl]propionic acid Formula: C24H22N2O4 MolecularWeight: 402.44248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)C2=CC=C(C=C2)CC(C(=O)O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

COC1=C(C(=CC=C1)OC)C2=CC=C(C=C2)CC(C(=O)O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C24H22N2O4/c1-29-21-7-4-8-22(30-2)23(21)18-11-9-16(10-12-18)14-20(24(27)28)26-19-6-3-5-17(13-19)15-25/h3-13,20,26H,14H2,1-2H3,(H,27,28)