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

Systemtic Name: 7-[[2-(4-butoxyphenyl)phenyl]carbonylamino]quinoline-3-carboxylic acid Openeye Name: 7-[[2-(4-butoxyphenyl)benzoyl]amino]quinoline-3-carboxylic acid CAS Name: 7-[[[2-(4-butoxyphenyl)phenyl]-oxomethyl]amino]-3-quinolinecarboxylic acid IUPAC Name: 7-[[2-(4-butoxyphenyl)benzoyl]amino]quinoline-3-carboxylic acid Traditional Name: 7-[[2-(4-butoxyphenyl)benzoyl]amino]quinoline-3-carboxylic acid Formula: C27H24N2O4 MolecularWeight: 440.49046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC4=NC=C(C=C4C=C3)C(=O)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C2=CC=CC=C2C(=O)NC3=CC4=NC=C(C=C4C=C3)C(=O)O

InChI

InChI=1S/C27H24N2O4/c1-2-3-14-33-22-12-9-18(10-13-22)23-6-4-5-7-24(23)26(30)29-21-11-8-19-15-20(27(31)32)17-28-25(19)16-21/h4-13,15-17H,2-3,14H2,1H3,(H,29,30)(H,31,32)