8-[4-[(7-naphthalen-2-yl-2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl)carbonylamino]phenoxy]octanoic acid

Systemtic Name: 8-[4-[(7-naphthalen-2-yl-2-oxidanyl-4-oxidanylidene-1H-quinolin-3-yl)carbonylamino]phenoxy]octanoic acid Openeye Name: 8-[4-[[2-hydroxy-7-(2-naphthyl)-4-oxo-1H-quinoline-3-carbonyl]amino]phenoxy]octanoic acid CAS Name: 8-[4-[[[2-hydroxy-7-(2-naphthalenyl)-4-oxo-1H-quinolin-3-yl]-oxomethyl]amino]phenoxy]octanoic acid IUPAC Name: 8-[4-[(2-hydroxy-7-naphthalen-2-yl-4-oxo-1H-quinoline-3-carbonyl)amino]phenoxy]octanoic acid Traditional Name: 8-[4-[[2-hydroxy-4-keto-7-(2-naphthyl)-1H-quinoline-3-carbonyl]amino]phenoxy]caprylic acid Formula: C34H32N2O6 MolecularWeight: 564.62768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=CC4=C(C=C3)C(=O)C(=C(N4)O)C(=O)NC5=CC=C(C=C5)OCCCCCCCC(=O)O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=CC4=C(C=C3)C(=O)C(=C(N4)O)C(=O)NC5=CC=C(C=C5)OCCCCCCCC(=O)O

InChI

InChI=1S/C34H32N2O6/c37-30(38)10-4-2-1-3-7-19-42-27-16-14-26(15-17-27)35-33(40)31-32(39)28-18-13-25(21-29(28)36-34(31)41)24-12-11-22-8-5-6-9-23(22)20-24/h5-6,8-9,11-18,20-21H,1-4,7,10,19H2,(H,35,40)(H,37,38)(H2,36,39,41)