methyl 4-[2-azanyl-3-cyano-6-(4-propylphenyl)pyridin-4-yl]benzoate

Systemtic Name: methyl 4-[2-azanyl-3-cyano-6-(4-propylphenyl)pyridin-4-yl]benzoate Openeye Name: methyl 4-[2-amino-3-cyano-6-(4-propylphenyl)-4-pyridyl]benzoate CAS Name: 4-[2-amino-3-cyano-6-(4-propylphenyl)-4-pyridinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-amino-3-cyano-6-(4-propylphenyl)pyridin-4-yl]benzoate Traditional Name: 4-[2-amino-3-cyano-6-(4-propylphenyl)-4-pyridyl]benzoic acid methyl ester Formula: C23H21N3O2 MolecularWeight: 371.43174

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)C(=O)OC)C#N)N

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=NC(=C(C(=C2)C3=CC=C(C=C3)C(=O)OC)C#N)N

InChI

InChI=1S/C23H21N3O2/c1-3-4-15-5-7-17(8-6-15)21-13-19(20(14-24)22(25)26-21)16-9-11-18(12-10-16)23(27)28-2/h5-13H,3-4H2,1-2H3,(H2,25,26)