3-cyano-2-[(phenylmethyl)amino]-6-(4-phenylphenyl)-1,2-dihydropyridine-4-carboxylic acid

Systemtic Name: 3-cyano-2-[(phenylmethyl)amino]-6-(4-phenylphenyl)-1,2-dihydropyridine-4-carboxylic acid Openeye Name: 2-(benzylamino)-3-cyano-6-(4-phenylphenyl)-1,2-dihydropyridine-4-carboxylic acid CAS Name: 3-cyano-2-[(phenylmethyl)amino]-6-(4-phenylphenyl)-1,2-dihydropyridine-4-carboxylic acid IUPAC Name: 2-(benzylamino)-3-cyano-6-(4-phenylphenyl)-1,2-dihydropyridine-4-carboxylic acid Traditional Name: 2-(benzylamino)-3-cyano-6-(4-phenylphenyl)-1,2-dihydropyridine-4-carboxylic acid Formula: C26H21N3O2 MolecularWeight: 407.46384

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2C(=C(C=C(N2)C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC2C(=C(C=C(N2)C3=CC=C(C=C3)C4=CC=CC=C4)C(=O)O)C#N

InChI

InChI=1S/C26H21N3O2/c27-16-23-22(26(30)31)15-24(29-25(23)28-17-18-7-3-1-4-8-18)21-13-11-20(12-14-21)19-9-5-2-6-10-19/h1-15,25,28-29H,17H2,(H,30,31)