2-azanyl-4-[2-(4-propan-2-ylphenyl)phenyl]carbonyl-quinoline-3-carboxylic acid

Systemtic Name: 2-azanyl-4-[2-(4-propan-2-ylphenyl)phenyl]carbonyl-quinoline-3-carboxylic acid Openeye Name: 2-amino-4-[2-(4-isopropylphenyl)benzoyl]quinoline-3-carboxylic acid CAS Name: 2-amino-4-[oxo-[2-(4-propan-2-ylphenyl)phenyl]methyl]-3-quinolinecarboxylic acid IUPAC Name: 2-amino-4-[2-(4-propan-2-ylphenyl)benzoyl]quinoline-3-carboxylic acid Traditional Name: 2-amino-4-(2-p-cumenylbenzoyl)quinoline-3-carboxylic acid Formula: C26H22N2O3 MolecularWeight: 410.46448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=CC=CC=C2C(=O)C3=C(C(=NC4=CC=CC=C43)N)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=CC=CC=C2C(=O)C3=C(C(=NC4=CC=CC=C43)N)C(=O)O

InChI

InChI=1S/C26H22N2O3/c1-15(2)16-11-13-17(14-12-16)18-7-3-4-8-19(18)24(29)22-20-9-5-6-10-21(20)28-25(27)23(22)26(30)31/h3-15H,1-2H3,(H2,27,28)(H,30,31)