ethyl 2-[4-[[(6-azanyl-5-chloranyl-2-oxidanylidene-1H-pyridin-3-yl)carbonylamino]methyl]piperidin-1-yl]-3-methyl-butanoate

Systemtic Name: ethyl 2-[4-[[(6-azanyl-5-chloranyl-2-oxidanylidene-1H-pyridin-3-yl)carbonylamino]methyl]piperidin-1-yl]-3-methyl-butanoate Openeye Name: ethyl 2-[4-[[(6-amino-5-chloro-2-oxo-1H-pyridine-3-carbonyl)amino]methyl]-1-piperidyl]-3-methyl-butanoate CAS Name: 2-[4-[[[(6-amino-5-chloro-2-oxo-1H-pyridin-3-yl)-oxomethyl]amino]methyl]-1-piperidinyl]-3-methylbutanoic acid ethyl ester IUPAC Name: ethyl 2-[4-[[(6-amino-5-chloro-2-oxo-1H-pyridine-3-carbonyl)amino]methyl]piperidin-1-yl]-3-methylbutanoate Traditional Name: 2-[4-[[(6-amino-5-chloro-2-keto-1H-pyridine-3-carbonyl)amino]methyl]piperidino]-3-methyl-butyric acid ethyl ester Formula: C19H29ClN4O4 MolecularWeight: 412.91096

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C)C)N1CCC(CC1)CNC(=O)C2=CC(=C(NC2=O)N)Cl

Isomeric SMILES

CCOC(=O)C(C(C)C)N1CCC(CC1)CNC(=O)C2=CC(=C(NC2=O)N)Cl

InChI

InChI=1S/C19H29ClN4O4/c1-4-28-19(27)15(11(2)3)24-7-5-12(6-8-24)10-22-17(25)13-9-14(20)16(21)23-18(13)26/h9,11-12,15H,4-8,10H2,1-3H3,(H,22,25)(H3,21,23,26)