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

Systemtic Name: 2-[2-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-3,4-bis(oxidanylidene)-2H-quinoline-1-carboxylic acid Openeye Name: 2-(2-tert-butoxycarbonylpiperazin-1-yl)-3,4-dioxo-2H-quinoline-1-carboxylic acid CAS Name: 2-[2-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-3,4-dioxo-2H-quinoline-1-carboxylic acid IUPAC Name: 2-[2-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]-3,4-dioxo-2H-quinoline-1-carboxylic acid Traditional Name: 2-(2-tert-butoxycarbonylpiperazino)-3,4-diketo-2H-quinoline-1-carboxylic acid Formula: C19H23N3O6 MolecularWeight: 389.40242

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CNCCN1C2C(=O)C(=O)C3=CC=CC=C3N2C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)C1CNCCN1C2C(=O)C(=O)C3=CC=CC=C3N2C(=O)O

InChI

InChI=1S/C19H23N3O6/c1-19(2,3)28-17(25)13-10-20-8-9-21(13)16-15(24)14(23)11-6-4-5-7-12(11)22(16)18(26)27/h4-7,13,16,20H,8-10H2,1-3H3,(H,26,27)