7-[[2-(4-tert-butylphenyl)phenyl]carbonylamino]quinoline-3-carboxylic acid

Systemtic Name: 7-[[2-(4-tert-butylphenyl)phenyl]carbonylamino]quinoline-3-carboxylic acid Openeye Name: 7-[[2-(4-tert-butylphenyl)benzoyl]amino]quinoline-3-carboxylic acid CAS Name: 7-[[[2-(4-tert-butylphenyl)phenyl]-oxomethyl]amino]-3-quinolinecarboxylic acid IUPAC Name: 7-[[2-(4-tert-butylphenyl)benzoyl]amino]quinoline-3-carboxylic acid Traditional Name: 7-[[2-(4-tert-butylphenyl)benzoyl]amino]quinoline-3-carboxylic acid Formula: C27H24N2O3 MolecularWeight: 424.49106

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC4=NC=C(C=C4C=C3)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC4=NC=C(C=C4C=C3)C(=O)O

InChI

InChI=1S/C27H24N2O3/c1-27(2,3)20-11-8-17(9-12-20)22-6-4-5-7-23(22)25(30)29-21-13-10-18-14-19(26(31)32)16-28-24(18)15-21/h4-16H,1-3H3,(H,29,30)(H,31,32)