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

Systemtic Name: 4-[4-pyrazol-1-yl-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butoxy]benzoic acid Openeye Name: 4-[4-pyrazol-1-yl-2-(1,1,4,4-tetramethyltetralin-6-yl)butoxy]benzoic acid CAS Name: 4-[4-(1-pyrazolyl)-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butoxy]benzoic acid IUPAC Name: 4-[4-pyrazol-1-yl-2-(5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)butoxy]benzoic acid Traditional Name: 4-[4-pyrazol-1-yl-2-(1,1,4,4-tetramethyltetralin-6-yl)butoxy]benzoic acid Formula: C28H34N2O3 MolecularWeight: 446.58116

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=CC(=C2)C(CCN3C=CC=N3)COC4=CC=C(C=C4)C(=O)O)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=CC(=C2)C(CCN3C=CC=N3)COC4=CC=C(C=C4)C(=O)O)(C)C)C

InChI

InChI=1S/C28H34N2O3/c1-27(2)13-14-28(3,4)25-18-21(8-11-24(25)27)22(12-17-30-16-5-15-29-30)19-33-23-9-6-20(7-10-23)26(31)32/h5-11,15-16,18,22H,12-14,17,19H2,1-4H3,(H,31,32)