ethyl 2,6-dimethyl-5-(3-morpholin-4-ium-4-ylpropylcarbamoylamino)pyridine-3-carboxylate

Systemtic Name: ethyl 2,6-dimethyl-5-(3-morpholin-4-ium-4-ylpropylcarbamoylamino)pyridine-3-carboxylate Openeye Name: ethyl 2,6-dimethyl-5-(3-morpholin-4-ium-4-ylpropylcarbamoylamino)pyridine-3-carboxylate CAS Name: 2,6-dimethyl-5-[[[3-(4-morpholin-4-iumyl)propylamino]-oxomethyl]amino]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2,6-dimethyl-5-(3-morpholin-4-ium-4-ylpropylcarbamoylamino)pyridine-3-carboxylate Traditional Name: 2,6-dimethyl-5-(3-morpholin-4-ium-4-ylpropylcarbamoylamino)nicotinic acid ethyl ester Formula: C18H29N4O4+ MolecularWeight: 365.44726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(N=C1C)C)NC(=O)NCCC[NH+]2CCOCC2

Isomeric SMILES

CCOC(=O)C1=CC(=C(N=C1C)C)NC(=O)NCCC[NH+]2CCOCC2

InChI

InChI=1S/C18H28N4O4/c1-4-26-17(23)15-12-16(14(3)20-13(15)2)21-18(24)19-6-5-7-22-8-10-25-11-9-22/h12H,4-11H2,1-3H3,(H2,19,21,24)/p+1