[2-[(2R)-2-ethoxycarbonylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate

Systemtic Name: [2-[(2R)-2-ethoxycarbonylpiperidin-1-yl]-2-oxidanylidene-ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate Openeye Name: [2-[(2R)-2-ethoxycarbonyl-1-piperidyl]-2-oxo-ethyl] 2-ethyl-3-methyl-quinoline-4-carboxylate CAS Name: 2-ethyl-3-methyl-4-quinolinecarboxylic acid [2-[(2R)-2-ethoxycarbonyl-1-piperidinyl]-2-oxoethyl] ester IUPAC Name: [2-[(2R)-2-ethoxycarbonylpiperidin-1-yl]-2-oxoethyl] 2-ethyl-3-methylquinoline-4-carboxylate Traditional Name: 2-ethyl-3-methyl-cinchoninic acid [2-[(2R)-2-carbethoxypiperidino]-2-keto-ethyl] ester Formula: C23H28N2O5 MolecularWeight: 412.47882

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC(=O)N3CCCCC3C(=O)OCC

Isomeric SMILES

CCC1=NC2=CC=CC=C2C(=C1C)C(=O)OCC(=O)N3CCCC[C@@H]3C(=O)OCC

InChI

InChI=1S/C23H28N2O5/c1-4-17-15(3)21(16-10-6-7-11-18(16)24-17)23(28)30-14-20(26)25-13-9-8-12-19(25)22(27)29-5-2/h6-7,10-11,19H,4-5,8-9,12-14H2,1-3H3/t19-/m1/s1