4-[(3-carboxy-2-oxidanyl-naphthalen-1-yl)methyl]-3-oxidanyl-naphthalene-2-carboxylic acid; 2-(diethylamino)-2-(2-phenylquinolin-8-yl)ethanol

Systemtic Name: 4-[(3-carboxy-2-oxidanyl-naphthalen-1-yl)methyl]-3-oxidanyl-naphthalene-2-carboxylic acid; 2-(diethylamino)-2-(2-phenylquinolin-8-yl)ethanol Openeye Name: 4-[(3-carboxy-2-hydroxy-1-naphthyl)methyl]-3-hydroxy-naphthalene-2-carboxylic acid; 2-(diethylamino)-2-(2-phenyl-8-quinolyl)ethanol CAS Name: 4-[(3-carboxy-2-hydroxy-1-naphthalenyl)methyl]-3-hydroxy-2-naphthalenecarboxylic acid; 2-(diethylamino)-2-(2-phenyl-8-quinolinyl)ethanol IUPAC Name: 4-[(3-carboxy-2-hydroxynaphthalen-1-yl)methyl]-3-hydroxynaphthalene-2-carboxylic acid; 2-(diethylamino)-2-(2-phenylquinolin-8-yl)ethanol Traditional Name: 4-[(3-carboxy-2-hydroxy-1-naphthyl)methyl]-3-hydroxy-2-naphthoic acid; 2-(diethylamino)-2-(2-phenyl-8-quinolyl)ethanol Formula: C44H40N2O7 MolecularWeight: 708.7976

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(CO)C1=CC=CC2=C1N=C(C=C2)C3=CC=CC=C3.C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O

Isomeric SMILES

CCN(CC)C(CO)C1=CC=CC2=C1N=C(C=C2)C3=CC=CC=C3.C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O

InChI

InChI=1S/C23H16O6.C21H24N2O/c24-20-16(14-7-3-1-5-12(14)9-18(20)22(26)27)11-17-15-8-4-2-6-13(15)10-19(21(17)25)23(28)29;1-3-23(4-2)20(15-24)18-12-8-11-17-13-14-19(22-21(17)18)16-9-6-5-7-10-16/h1-10,24-25H,11H2,(H,26,27)(H,28,29);5-14,20,24H,3-4,15H2,1-2H3