ethyl 5-cyano-2-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-2-[4-(2-hydroxyethyl)-1-piperazinyl]-6-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-[4-(2-hydroxyethyl)piperazin-1-yl]-6-methylpyridine-3-carboxylate Traditional Name: 5-cyano-2-[4-(2-hydroxyethyl)piperazino]-6-methyl-nicotinic acid ethyl ester Formula: C16H22N4O3 MolecularWeight: 318.37088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)C)N2CCN(CC2)CCO

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)C)N2CCN(CC2)CCO

InChI

InChI=1S/C16H22N4O3/c1-3-23-16(22)14-10-13(11-17)12(2)18-15(14)20-6-4-19(5-7-20)8-9-21/h10,21H,3-9H2,1-2H3