[4-[2-azanyl-3-cyano-6-(4-methylphenyl)pyridin-4-yl]phenyl] (Z)-3-phenylprop-2-enoate

Systemtic Name: [4-[2-azanyl-3-cyano-6-(4-methylphenyl)pyridin-4-yl]phenyl] (Z)-3-phenylprop-2-enoate Openeye Name: [4-[2-amino-3-cyano-6-(p-tolyl)-4-pyridyl]phenyl] (Z)-3-phenylprop-2-enoate CAS Name: (Z)-3-phenyl-2-propenoic acid [4-[2-amino-3-cyano-6-(4-methylphenyl)-4-pyridinyl]phenyl] ester IUPAC Name: [4-[2-amino-3-cyano-6-(4-methylphenyl)pyridin-4-yl]phenyl] (Z)-3-phenylprop-2-enoate Traditional Name: (Z)-3-phenylacrylic acid [4-[2-amino-3-cyano-6-(p-tolyl)-4-pyridyl]phenyl] ester Formula: C28H21N3O2 MolecularWeight: 431.48524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)OC(=O)C=CC4=CC=CC=C4)C#N)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)OC(=O)/C=C\C4=CC=CC=C4)C#N)N

InChI

InChI=1S/C28H21N3O2/c1-19-7-10-22(11-8-19)26-17-24(25(18-29)28(30)31-26)21-12-14-23(15-13-21)33-27(32)16-9-20-5-3-2-4-6-20/h2-17H,1H3,(H2,30,31)/b16-9-