4-[(3,8,8-trimethyl-6,7-dihydro-5H-naphthalen-2-yl)sulfanyl]benzoic acid

Systemtic Name: 4-[(3,8,8-trimethyl-6,7-dihydro-5H-naphthalen-2-yl)sulfanyl]benzoic acid Openeye Name: 4-(4,4,7-trimethyltetralin-6-yl)sulfanylbenzoic acid CAS Name: 4-[(3,8,8-trimethyl-6,7-dihydro-5H-naphthalen-2-yl)thio]benzoic acid IUPAC Name: 4-[(3,8,8-trimethyl-6,7-dihydro-5H-naphthalen-2-yl)sulfanyl]benzoic acid Traditional Name: 4-[(4,4,7-trimethyltetralin-6-yl)thio]benzoic acid Formula: C20H22O2S MolecularWeight: 326.45248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)CCCC2(C)C)SC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=C(C=C2C(=C1)CCCC2(C)C)SC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C20H22O2S/c1-13-11-15-5-4-10-20(2,3)17(15)12-18(13)23-16-8-6-14(7-9-16)19(21)22/h6-9,11-12H,4-5,10H2,1-3H3,(H,21,22)