2-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]quinoline-4-carboxylic acid

Systemtic Name: 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]quinoline-4-carboxylic acid Openeye Name: 2-(1-tert-butoxycarbonylindol-3-yl)quinoline-4-carboxylic acid CAS Name: 2-[1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-indolyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[1-[(2-methylpropan-2-yl)oxycarbonyl]indol-3-yl]quinoline-4-carboxylic acid Traditional Name: 2-(1-tert-butoxycarbonylindol-3-yl)cinchoninic acid Formula: C23H20N2O4 MolecularWeight: 388.4159

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3=NC4=CC=CC=C4C(=C3)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)C3=NC4=CC=CC=C4C(=C3)C(=O)O

InChI

InChI=1S/C23H20N2O4/c1-23(2,3)29-22(28)25-13-17(15-9-5-7-11-20(15)25)19-12-16(21(26)27)14-8-4-6-10-18(14)24-19/h4-13H,1-3H3,(H,26,27)