4-[[2-[(4-azanyl-2-methyl-quinolin-6-yl)carbamoyl]phenyl]methoxy]benzoic acid

Systemtic Name: 4-[[2-[(4-azanyl-2-methyl-quinolin-6-yl)carbamoyl]phenyl]methoxy]benzoic acid Openeye Name: 4-[[2-[(4-amino-2-methyl-6-quinolyl)carbamoyl]phenyl]methoxy]benzoic acid CAS Name: 4-[[2-[[(4-amino-2-methyl-6-quinolinyl)amino]-oxomethyl]phenyl]methoxy]benzoic acid IUPAC Name: 4-[[2-[(4-amino-2-methylquinolin-6-yl)carbamoyl]phenyl]methoxy]benzoic acid Traditional Name: 4-[2-[(4-amino-2-methyl-6-quinolyl)carbamoyl]benzyl]oxybenzoic acid Formula: C25H21N3O4 MolecularWeight: 427.45194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3COC4=CC=C(C=C4)C(=O)O)C(=C1)N

Isomeric SMILES

CC1=NC2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3COC4=CC=C(C=C4)C(=O)O)C(=C1)N

InChI

InChI=1S/C25H21N3O4/c1-15-12-22(26)21-13-18(8-11-23(21)27-15)28-24(29)20-5-3-2-4-17(20)14-32-19-9-6-16(7-10-19)25(30)31/h2-13H,14H2,1H3,(H2,26,27)(H,28,29)(H,30,31)