4-[5-oxidanylidene-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-4H-pyrazol-1-yl]benzoic acid

Systemtic Name: 4-[5-oxidanylidene-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-4H-pyrazol-1-yl]benzoic acid Openeye Name: 4-[5-oxo-3-(1,1,4,4-tetramethyltetralin-6-yl)-4H-pyrazol-1-yl]benzoic acid CAS Name: 4-[5-oxo-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-4H-pyrazol-1-yl]benzoic acid IUPAC Name: 4-[5-oxo-3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-4H-pyrazol-1-yl]benzoic acid Traditional Name: 4-[5-keto-3-(1,1,4,4-tetramethyltetralin-6-yl)-2-pyrazolin-1-yl]benzoic acid Formula: C24H26N2O3 MolecularWeight: 390.47484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)C3=NN(C(=O)C3)C4=CC=C(C=C4)C(=O)O)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)C3=NN(C(=O)C3)C4=CC=C(C=C4)C(=O)O)(C)C)C

InChI

InChI=1S/C24H26N2O3/c1-23(2)11-12-24(3,4)19-13-16(7-10-18(19)23)20-14-21(27)26(25-20)17-8-5-15(6-9-17)22(28)29/h5-10,13H,11-12,14H2,1-4H3,(H,28,29)