6-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)naphthalene-2-carboxylic acid

Systemtic Name: 6-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)naphthalene-2-carboxylic acid Openeye Name: 6-(4,4-dimethylthiochroman-6-yl)naphthalene-2-carboxylic acid CAS Name: 6-(4,4-dimethyl-2,3-dihydro-1-benzothiopyran-6-yl)-2-naphthalenecarboxylic acid IUPAC Name: 6-(4,4-dimethyl-2,3-dihydrothiochromen-6-yl)naphthalene-2-carboxylic acid Traditional Name: 6-(4,4-dimethylthiochroman-6-yl)-2-naphthoic acid Formula: C22H20O2S MolecularWeight: 348.458

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCSC2=C1C=C(C=C2)C3=CC4=C(C=C3)C=C(C=C4)C(=O)O)C

Isomeric SMILES

CC1(CCSC2=C1C=C(C=C2)C3=CC4=C(C=C3)C=C(C=C4)C(=O)O)C

InChI

InChI=1S/C22H20O2S/c1-22(2)9-10-25-20-8-7-17(13-19(20)22)15-3-4-16-12-18(21(23)24)6-5-14(16)11-15/h3-8,11-13H,9-10H2,1-2H3,(H,23,24)