4-[[2-(5,5-dimethyl-8-oxidanyl-8-quinolin-3-yl-6,7-dihydronaphthalen-2-yl)naphthalen-1-yl]carbonylamino]benzoic acid

Systemtic Name: 4-[[2-(5,5-dimethyl-8-oxidanyl-8-quinolin-3-yl-6,7-dihydronaphthalen-2-yl)naphthalen-1-yl]carbonylamino]benzoic acid Openeye Name: 4-[[2-[4-hydroxy-1,1-dimethyl-4-(3-quinolyl)tetralin-6-yl]naphthalene-1-carbonyl]amino]benzoic acid CAS Name: 4-[[[2-[8-hydroxy-5,5-dimethyl-8-(3-quinolinyl)-6,7-dihydronaphthalen-2-yl]-1-naphthalenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 4-[[2-(8-hydroxy-5,5-dimethyl-8-quinolin-3-yl-6,7-dihydronaphthalen-2-yl)naphthalene-1-carbonyl]amino]benzoic acid Traditional Name: 4-[[2-[4-hydroxy-1,1-dimethyl-4-(3-quinolyl)tetralin-6-yl]-1-naphthoyl]amino]benzoic acid Formula: C39H32N2O4 MolecularWeight: 592.68238

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)C3=C(C4=CC=CC=C4C=C3)C(=O)NC5=CC=C(C=C5)C(=O)O)(C6=CC7=CC=CC=C7N=C6)O)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)C3=C(C4=CC=CC=C4C=C3)C(=O)NC5=CC=C(C=C5)C(=O)O)(C6=CC7=CC=CC=C7N=C6)O)C

InChI

InChI=1S/C39H32N2O4/c1-38(2)19-20-39(45,28-21-27-8-4-6-10-34(27)40-23-28)33-22-26(14-18-32(33)38)31-17-13-24-7-3-5-9-30(24)35(31)36(42)41-29-15-11-25(12-16-29)37(43)44/h3-18,21-23,45H,19-20H2,1-2H3,(H,41,42)(H,43,44)