[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] pyridine-4-carboxylate

Systemtic Name: [2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] pyridine-4-carboxylate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl] pyridine-4-carboxylate CAS Name: 4-pyridinecarboxylic acid [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] pyridine-4-carboxylate Traditional Name: isonicotinic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl] ester Formula: C15H17N3O3 MolecularWeight: 287.31378

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NC(=O)COC(=O)C2=CC=NC=C2

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)COC(=O)C2=CC=NC=C2

InChI

InChI=1S/C15H17N3O3/c16-11-15(6-2-1-3-7-15)18-13(19)10-21-14(20)12-4-8-17-9-5-12/h4-5,8-9H,1-3,6-7,10H2,(H,18,19)