methyl 4-(1-methylpyrrolidin-1-ium-3-yl)-3-oxidanylidene-butanoate

Systemtic Name: methyl 4-(1-methylpyrrolidin-1-ium-3-yl)-3-oxidanylidene-butanoate Openeye Name: methyl 4-(1-methylpyrrolidin-1-ium-3-yl)-3-oxo-butanoate CAS Name: 4-(1-methyl-3-pyrrolidin-1-iumyl)-3-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(1-methylpyrrolidin-1-ium-3-yl)-3-oxobutanoate Traditional Name: 3-keto-4-(1-methylpyrrolidin-1-ium-3-yl)butyric acid methyl ester Formula: C10H18NO3+ MolecularWeight: 200.25482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H17NO3/c1-11-4-3-8(7-11)5-9(12)6-10(13)14-2/h8H,3-7H2,1-2H3/p+1