methyl 3-azanyl-2-(piperidin-1-ium-1-ylmethyl)benzoate

Systemtic Name: methyl 3-azanyl-2-(piperidin-1-ium-1-ylmethyl)benzoate Openeye Name: methyl 3-amino-2-(piperidin-1-ium-1-ylmethyl)benzoate CAS Name: 3-amino-2-(1-piperidin-1-iumylmethyl)benzoic acid methyl ester IUPAC Name: methyl 3-amino-2-(piperidin-1-ium-1-ylmethyl)benzoate Traditional Name: 3-amino-2-(piperidin-1-ium-1-ylmethyl)benzoic acid methyl ester Formula: C14H21N2O2+ MolecularWeight: 249.32874

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC=C1)N)C[NH+]2CCCCC2

Isomeric SMILES

COC(=O)C1=C(C(=CC=C1)N)C[NH+]2CCCCC2

InChI

InChI=1S/C14H20N2O2/c1-18-14(17)11-6-5-7-13(15)12(11)10-16-8-3-2-4-9-16/h5-7H,2-4,8-10,15H2,1H3/p+1