3-[4-[(7-chloranylquinolin-4-yl)amino]phenyl]-3-methyl-butanoic acid

Systemtic Name: 3-[4-[(7-chloranylquinolin-4-yl)amino]phenyl]-3-methyl-butanoic acid Openeye Name: 3-[4-[(7-chloro-4-quinolyl)amino]phenyl]-3-methyl-butanoic acid CAS Name: 3-[4-[(7-chloro-4-quinolinyl)amino]phenyl]-3-methylbutanoic acid IUPAC Name: 3-[4-[(7-chloroquinolin-4-yl)amino]phenyl]-3-methylbutanoic acid Traditional Name: 3-[4-[(7-chloro-4-quinolyl)amino]phenyl]-3-methyl-butyric acid Formula: C20H19ClN2O2 MolecularWeight: 354.83006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CC(=O)O)C1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC=C2)Cl

Isomeric SMILES

CC(C)(CC(=O)O)C1=CC=C(C=C1)NC2=C3C=CC(=CC3=NC=C2)Cl

InChI

InChI=1S/C20H19ClN2O2/c1-20(2,12-19(24)25)13-3-6-15(7-4-13)23-17-9-10-22-18-11-14(21)5-8-16(17)18/h3-11H,12H2,1-2H3,(H,22,23)(H,24,25)