5-[[(3S)-3-ethoxycarbonylpiperidin-1-ium-1-yl]methyl]quinolin-8-olate

Systemtic Name: 5-[[(3S)-3-ethoxycarbonylpiperidin-1-ium-1-yl]methyl]quinolin-8-olate Openeye Name: 5-[[(3S)-3-ethoxycarbonylpiperidin-1-ium-1-yl]methyl]quinolin-8-olate CAS Name: 5-[[(3S)-3-ethoxycarbonyl-1-piperidin-1-iumyl]methyl]-8-quinolinolate IUPAC Name: 5-[[(3S)-3-ethoxycarbonylpiperidin-1-ium-1-yl]methyl]quinolin-8-olate Traditional Name: 5-[[(3S)-3-carbethoxypiperidin-1-ium-1-yl]methyl]quinolin-8-olate Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCC[NH+](C1)CC2=C3C=CC=NC3=C(C=C2)[O-]

Isomeric SMILES

CCOC(=O)[C@H]1CCC[NH+](C1)CC2=C3C=CC=NC3=C(C=C2)[O-]

InChI

InChI=1S/C18H22N2O3/c1-2-23-18(22)14-5-4-10-20(12-14)11-13-7-8-16(21)17-15(13)6-3-9-19-17/h3,6-9,14,21H,2,4-5,10-12H2,1H3/t14-/m0/s1