4-[[(4-dimethylaminophenyl)-(8-oxidanylquinolin-7-yl)methyl]amino]benzoic acid

Systemtic Name: 4-[[(4-dimethylaminophenyl)-(8-oxidanylquinolin-7-yl)methyl]amino]benzoic acid Openeye Name: 4-[[(4-dimethylaminophenyl)-(8-hydroxy-7-quinolyl)methyl]amino]benzoic acid CAS Name: 4-[[(4-dimethylaminophenyl)-(8-hydroxy-7-quinolinyl)methyl]amino]benzoic acid IUPAC Name: 4-[[(4-dimethylaminophenyl)-(8-hydroxyquinolin-7-yl)methyl]amino]benzoic acid Traditional Name: 4-[[(4-dimethylaminophenyl)-(8-hydroxy-7-quinolyl)methyl]amino]benzoic acid Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C2=C(C3=C(C=CC=N3)C=C2)O)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(C2=C(C3=C(C=CC=N3)C=C2)O)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C25H23N3O3/c1-28(2)20-12-7-17(8-13-20)22(27-19-10-5-18(6-11-19)25(30)31)21-14-9-16-4-3-15-26-23(16)24(21)29/h3-15,22,27,29H,1-2H3,(H,30,31)