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

Systemtic Name: methyl 3-[4-[[(6-azanyl-5-chloranyl-2-oxidanylidene-1H-pyridin-3-yl)carbonylamino]methyl]piperidin-1-yl]propanoate Openeye Name: methyl 3-[4-[[(6-amino-5-chloro-2-oxo-1H-pyridine-3-carbonyl)amino]methyl]-1-piperidyl]propanoate CAS Name: 3-[4-[[[(6-amino-5-chloro-2-oxo-1H-pyridin-3-yl)-oxomethyl]amino]methyl]-1-piperidinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-[[(6-amino-5-chloro-2-oxo-1H-pyridine-3-carbonyl)amino]methyl]piperidin-1-yl]propanoate Traditional Name: 3-[4-[[(6-amino-5-chloro-2-keto-1H-pyridine-3-carbonyl)amino]methyl]piperidino]propionic acid methyl ester Formula: C16H23ClN4O4 MolecularWeight: 370.83122

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCN1CCC(CC1)CNC(=O)C2=CC(=C(NC2=O)N)Cl

Isomeric SMILES

COC(=O)CCN1CCC(CC1)CNC(=O)C2=CC(=C(NC2=O)N)Cl

InChI

InChI=1S/C16H23ClN4O4/c1-25-13(22)4-7-21-5-2-10(3-6-21)9-19-15(23)11-8-12(17)14(18)20-16(11)24/h8,10H,2-7,9H2,1H3,(H,19,23)(H3,18,20,24)