methyl 4-(1-methyl-4-oxidanyl-pyrrolidin-1-ium-3-yl)-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-(1-methyl-4-oxidanyl-pyrrolidin-1-ium-3-yl)-3-oxidanylidene-butanoate Openeye Name: methyl 4-(4-hydroxy-1-methyl-pyrrolidin-1-ium-3-yl)-3-oxo-butanoate CAS Name: 4-(4-hydroxy-1-methyl-3-pyrrolidin-1-iumyl)-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(4-hydroxy-1-methylpyrrolidin-1-ium-3-yl)-3-oxobutanoate Traditional Name: 4-(4-hydroxy-1-methyl-pyrrolidin-1-ium-3-yl)-3-keto-butyric acid methyl ester Formula: C10H18NO4+ MolecularWeight: 216.25422

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC(C(C1)O)CC(=O)CC(=O)OC

Isomeric SMILES

C[NH+]1CC(C(C1)O)CC(=O)CC(=O)OC

InChI

InChI=1S/C10H17NO4/c1-11-5-7(9(13)6-11)3-8(12)4-10(14)15-2/h7,9,13H,3-6H2,1-2H3/p+1