[3-(4-cyanophenyl)propanoylamino] 4-methyl-6-(methylamino)pyridine-3-carboxylate

Systemtic Name: [3-(4-cyanophenyl)propanoylamino] 4-methyl-6-(methylamino)pyridine-3-carboxylate Openeye Name: [3-(4-cyanophenyl)propanoylamino] 4-methyl-6-(methylamino)pyridine-3-carboxylate CAS Name: 4-methyl-6-(methylamino)-3-pyridinecarboxylic acid [[3-(4-cyanophenyl)-1-oxopropyl]amino] ester IUPAC Name: [3-(4-cyanophenyl)propanoylamino] 4-methyl-6-(methylamino)pyridine-3-carboxylate Traditional Name: 4-methyl-6-(methylamino)nicotinic acid [3-(4-cyanophenyl)propanoylamino] ester Formula: C18H18N4O3 MolecularWeight: 338.36052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1C(=O)ONC(=O)CCC2=CC=C(C=C2)C#N)NC

Isomeric SMILES

CC1=CC(=NC=C1C(=O)ONC(=O)CCC2=CC=C(C=C2)C#N)NC

InChI

InChI=1S/C18H18N4O3/c1-12-9-16(20-2)21-11-15(12)18(24)25-22-17(23)8-7-13-3-5-14(10-19)6-4-13/h3-6,9,11H,7-8H2,1-2H3,(H,20,21)(H,22,23)