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

Systemtic Name: 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-2-yl]methyl]-2-oxidanylidene-1H-quinoline-4-carboxylic acid Openeye Name: 3-[(1-tert-butoxycarbonyl-2-piperidyl)methyl]-2-oxo-1H-quinoline-4-carboxylic acid CAS Name: 3-[[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-2-piperidinyl]methyl]-2-oxo-1H-quinoline-4-carboxylic acid IUPAC Name: 3-[[1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-2-yl]methyl]-2-oxo-1H-quinoline-4-carboxylic acid Traditional Name: 3-[(1-tert-butoxycarbonyl-2-piperidyl)methyl]-2-keto-1H-quinoline-4-carboxylic acid Formula: C21H26N2O5 MolecularWeight: 386.44154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCCC1CC2=C(C3=CC=CC=C3NC2=O)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCCC1CC2=C(C3=CC=CC=C3NC2=O)C(=O)O

InChI

InChI=1S/C21H26N2O5/c1-21(2,3)28-20(27)23-11-7-6-8-13(23)12-15-17(19(25)26)14-9-4-5-10-16(14)22-18(15)24/h4-5,9-10,13H,6-8,11-12H2,1-3H3,(H,22,24)(H,25,26)