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

Systemtic Name: 4-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1H-pyrazol-5-yl]benzoic acid Openeye Name: 4-[3-(1,1,4,4-tetramethyltetralin-6-yl)-1H-pyrazol-5-yl]benzoic acid CAS Name: 4-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1H-pyrazol-5-yl]benzoic acid IUPAC Name: 4-[3-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-1H-pyrazol-5-yl]benzoic acid Traditional Name: 4-[3-(1,1,4,4-tetramethyltetralin-6-yl)-1H-pyrazol-5-yl]benzoic acid Formula: C24H26N2O2 MolecularWeight: 374.47544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H26N2O2/c1-23(2)11-12-24(3,4)19-13-17(9-10-18(19)23)21-14-20(25-26-21)15-5-7-16(8-6-15)22(27)28/h5-10,13-14H,11-12H2,1-4H3,(H,25,26)(H,27,28)