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

Systemtic Name: 3-[2-[(2-methylpropan-2-yl)oxycarbonyl-(phenylmethyl)amino]ethyl]-2-oxidanylidene-1H-quinoline-4-carboxylic acid Openeye Name: 3-[2-[benzyl(tert-butoxycarbonyl)amino]ethyl]-2-oxo-1H-quinoline-4-carboxylic acid CAS Name: 3-[2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-(phenylmethyl)amino]ethyl]-2-oxo-1H-quinoline-4-carboxylic acid IUPAC Name: 3-[2-[benzyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]ethyl]-2-oxo-1H-quinoline-4-carboxylic acid Traditional Name: 3-[2-[benzyl(tert-butoxycarbonyl)amino]ethyl]-2-keto-1H-quinoline-4-carboxylic acid Formula: C24H26N2O5 MolecularWeight: 422.47364

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCC1=C(C2=CC=CC=C2NC1=O)C(=O)O)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N(CCC1=C(C2=CC=CC=C2NC1=O)C(=O)O)CC3=CC=CC=C3

InChI

InChI=1S/C24H26N2O5/c1-24(2,3)31-23(30)26(15-16-9-5-4-6-10-16)14-13-18-20(22(28)29)17-11-7-8-12-19(17)25-21(18)27/h4-12H,13-15H2,1-3H3,(H,25,27)(H,28,29)