4-(4-methyl-1-oxidanidyl-piperidin-1-ium-1-yl)but-2-ynyl ethanoate

Systemtic Name: 4-(4-methyl-1-oxidanidyl-piperidin-1-ium-1-yl)but-2-ynyl ethanoate Openeye Name: 4-(4-methyl-1-oxido-piperidin-1-ium-1-yl)but-2-ynyl acetate CAS Name: acetic acid 4-(4-methyl-1-oxido-1-piperidin-1-iumyl)but-2-ynyl ester IUPAC Name: 4-(4-methyl-1-oxidopiperidin-1-ium-1-yl)but-2-ynyl acetate Traditional Name: acetic acid 4-(4-methyl-1-oxido-piperidin-1-ium-1-yl)but-2-ynyl ester Formula: C12H19NO3 MolecularWeight: 225.28416

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[N+](CC1)(CC#CCOC(=O)C)[O-]

Isomeric SMILES

CC1CC[N+](CC1)(CC#CCOC(=O)C)[O-]

InChI

InChI=1S/C12H19NO3/c1-11-5-8-13(15,9-6-11)7-3-4-10-16-12(2)14/h11H,5-10H2,1-2H3