3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]-2-oxidanylidene-1H-quinoline-4-carboxylic acid

Systemtic Name: 3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]-2-oxidanylidene-1H-quinoline-4-carboxylic acid Openeye Name: 3-(1-tert-butoxycarbonyl-3-piperidyl)-2-oxo-1H-quinoline-4-carboxylic acid CAS Name: 3-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-piperidinyl]-2-oxo-1H-quinoline-4-carboxylic acid IUPAC Name: 3-[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]-2-oxo-1H-quinoline-4-carboxylic acid Traditional Name: 3-(1-tert-butoxycarbonyl-3-piperidyl)-2-keto-1H-quinoline-4-carboxylic acid Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC(C1)C2=C(C3=CC=CC=C3NC2=O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC(C1)C2=C(C3=CC=CC=C3NC2=O)C(=O)O

InChI

InChI=1S/C20H24N2O5/c1-20(2,3)27-19(26)22-10-6-7-12(11-22)15-16(18(24)25)13-8-4-5-9-14(13)21-17(15)23/h4-5,8-9,12H,6-7,10-11H2,1-3H3,(H,21,23)(H,24,25)