7-[[2-(4-propan-2-ylphenyl)pyridin-3-yl]carbonylamino]quinoline-3-carboxylic acid

Systemtic Name: 7-[[2-(4-propan-2-ylphenyl)pyridin-3-yl]carbonylamino]quinoline-3-carboxylic acid Openeye Name: 7-[[2-(4-isopropylphenyl)pyridine-3-carbonyl]amino]quinoline-3-carboxylic acid CAS Name: 7-[[oxo-[2-(4-propan-2-ylphenyl)-3-pyridinyl]methyl]amino]-3-quinolinecarboxylic acid IUPAC Name: 7-[[2-(4-propan-2-ylphenyl)pyridine-3-carbonyl]amino]quinoline-3-carboxylic acid Traditional Name: 7-[(2-p-cumenylnicotinoyl)amino]quinoline-3-carboxylic acid Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=C(C=CC=N2)C(=O)NC3=CC4=NC=C(C=C4C=C3)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=C(C=CC=N2)C(=O)NC3=CC4=NC=C(C=C4C=C3)C(=O)O

InChI

InChI=1S/C25H21N3O3/c1-15(2)16-5-7-17(8-6-16)23-21(4-3-11-26-23)24(29)28-20-10-9-18-12-19(25(30)31)14-27-22(18)13-20/h3-15H,1-2H3,(H,28,29)(H,30,31)