methyl 1-(2-morpholin-4-ium-4-ylethyl)-6-oxidanylidene-pyridine-3-carboxylate

Systemtic Name: methyl 1-(2-morpholin-4-ium-4-ylethyl)-6-oxidanylidene-pyridine-3-carboxylate Openeye Name: methyl 1-(2-morpholin-4-ium-4-ylethyl)-6-oxo-pyridine-3-carboxylate CAS Name: 1-[2-(4-morpholin-4-iumyl)ethyl]-6-oxo-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-morpholin-4-ium-4-ylethyl)-6-oxopyridine-3-carboxylate Traditional Name: 6-keto-1-(2-morpholin-4-ium-4-ylethyl)nicotinic acid methyl ester Formula: C13H19N2O4+ MolecularWeight: 267.30096

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(C(=O)C=C1)CC[NH+]2CCOCC2

Isomeric SMILES

COC(=O)C1=CN(C(=O)C=C1)CC[NH+]2CCOCC2

InChI

InChI=1S/C13H18N2O4/c1-18-13(17)11-2-3-12(16)15(10-11)5-4-14-6-8-19-9-7-14/h2-3,10H,4-9H2,1H3/p+1