ethyl 6-[4-[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 6-[4-[2-[(5-chloranylpyridin-2-yl)amino]-2-oxidanylidene-ethyl]piperazin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 6-[4-[2-[(5-chloro-2-pyridyl)amino]-2-oxo-ethyl]piperazin-1-yl]pyridine-3-carboxylate CAS Name: 6-[4-[2-[(5-chloro-2-pyridinyl)amino]-2-oxoethyl]-1-piperazinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-[2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl]piperazin-1-yl]pyridine-3-carboxylate Traditional Name: 6-[4-[2-[(5-chloro-2-pyridyl)amino]-2-keto-ethyl]piperazino]nicotinic acid ethyl ester Formula: C19H22ClN5O3 MolecularWeight: 403.86268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)CC(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=CN=C(C=C1)N2CCN(CC2)CC(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN5O3/c1-2-28-19(27)14-3-6-17(22-11-14)25-9-7-24(8-10-25)13-18(26)23-16-5-4-15(20)12-21-16/h3-6,11-12H,2,7-10,13H2,1H3,(H,21,23,26)