methyl 1-[2-[(2,3-dimethoxyphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate

Systemtic Name: methyl 1-[2-[(2,3-dimethoxyphenyl)methyl-methyl-amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[2-[(2,3-dimethoxyphenyl)methyl-methyl-amino]-2-oxo-ethyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[2-[(2,3-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(2,3-dimethoxyphenyl)methyl-methylamino]-2-oxoethyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[2-keto-2-[methyl(o-veratryl)amino]ethyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C19H29N2O5+ MolecularWeight: 365.44396

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C(=CC=C1)OC)OC)C(=O)C[NH+]2CCC(CC2)C(=O)OC

Isomeric SMILES

CN(CC1=C(C(=CC=C1)OC)OC)C(=O)C[NH+]2CCC(CC2)C(=O)OC

InChI

InChI=1S/C19H28N2O5/c1-20(12-15-6-5-7-16(24-2)18(15)25-3)17(22)13-21-10-8-14(9-11-21)19(23)26-4/h5-7,14H,8-13H2,1-4H3/p+1