methyl 2-[1-(cyclopropylmethyl)piperidin-1-ium-4-yl]ethanoate

Systemtic Name: methyl 2-[1-(cyclopropylmethyl)piperidin-1-ium-4-yl]ethanoate Openeye Name: methyl 2-[1-(cyclopropylmethyl)piperidin-1-ium-4-yl]acetate CAS Name: 2-[1-(cyclopropylmethyl)-4-piperidin-1-iumyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-(cyclopropylmethyl)piperidin-1-ium-4-yl]acetate Traditional Name: 2-[1-(cyclopropylmethyl)piperidin-1-ium-4-yl]acetic acid methyl ester Formula: C12H22NO2+ MolecularWeight: 212.30858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CC[NH+](CC1)CC2CC2

Isomeric SMILES

COC(=O)CC1CC[NH+](CC1)CC2CC2

InChI

InChI=1S/C12H21NO2/c1-15-12(14)8-10-4-6-13(7-5-10)9-11-2-3-11/h10-11H,2-9H2,1H3/p+1