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

Systemtic Name: 2-[2-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-4-oxidanylidene-1H-quinoline-3-carboxylic acid Openeye Name: 2-(2-tert-butoxycarbonylpiperazin-1-yl)-4-oxo-1H-quinoline-3-carboxylic acid CAS Name: 2-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-4-oxo-1H-quinoline-3-carboxylic acid IUPAC Name: 2-[2-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-4-oxo-1H-quinoline-3-carboxylic acid Traditional Name: 2-(2-tert-butoxycarbonylpiperazino)-4-keto-1H-quinoline-3-carboxylic acid Formula: C19H23N3O5 MolecularWeight: 373.40302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CNCCN1C2=C(C(=O)C3=CC=CC=C3N2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)C1CNCCN1C2=C(C(=O)C3=CC=CC=C3N2)C(=O)O

InChI

InChI=1S/C19H23N3O5/c1-19(2,3)27-18(26)13-10-20-8-9-22(13)16-14(17(24)25)15(23)11-6-4-5-7-12(11)21-16/h4-7,13,20H,8-10H2,1-3H3,(H,21,23)(H,24,25)