ethyl (2R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]piperidin-1-ium-2-carboxylate

Systemtic Name: ethyl (2R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]piperidin-1-ium-2-carboxylate Openeye Name: ethyl (2R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]piperidin-1-ium-2-carboxylate CAS Name: (2R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-2-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl (2R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]piperidin-1-ium-2-carboxylate Traditional Name: (2R)-1-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]piperidin-1-ium-2-carboxylic acid ethyl ester Formula: C19H27N2O3+ MolecularWeight: 331.42928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCC[NH+]1CC(=O)N2CCCC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)[C@H]1CCCC[NH+]1CC(=O)N2CCCC3=CC=CC=C32

InChI

InChI=1S/C19H26N2O3/c1-2-24-19(23)17-11-5-6-12-20(17)14-18(22)21-13-7-9-15-8-3-4-10-16(15)21/h3-4,8,10,17H,2,5-7,9,11-14H2,1H3/p+1/t17-/m1/s1