4-[(3-bromanyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbonyl]benzoic acid

Systemtic Name: 4-[(3-bromanyl-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)carbonyl]benzoic acid Openeye Name: 4-(7-bromo-1,1,4,4-tetramethyl-tetralin-6-carbonyl)benzoic acid CAS Name: 4-[(3-bromo-5,5,8,8-tetramethyl-6,7-dihydronaphthalen-2-yl)-oxomethyl]benzoic acid IUPAC Name: 4-(3-bromo-5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbonyl)benzoic acid Traditional Name: 4-(7-bromo-1,1,4,4-tetramethyl-tetralin-6-carbonyl)benzoic acid Formula: C22H23BrO3 MolecularWeight: 415.32022

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(C2=C1C=C(C(=C2)Br)C(=O)C3=CC=C(C=C3)C(=O)O)(C)C)C

Isomeric SMILES

CC1(CCC(C2=C1C=C(C(=C2)Br)C(=O)C3=CC=C(C=C3)C(=O)O)(C)C)C

InChI

InChI=1S/C22H23BrO3/c1-21(2)9-10-22(3,4)17-12-18(23)15(11-16(17)21)19(24)13-5-7-14(8-6-13)20(25)26/h5-8,11-12H,9-10H2,1-4H3,(H,25,26)