6,8-dibutyl-3,4-dihydro-2H-thiochromene-4-carboxylic acid

Systemtic Name: 6,8-dibutyl-3,4-dihydro-2H-thiochromene-4-carboxylic acid Openeye Name: 6,8-dibutylthiochromane-4-carboxylic acid CAS Name: 6,8-dibutyl-3,4-dihydro-2H-1-benzothiopyran-4-carboxylic acid IUPAC Name: 6,8-dibutyl-3,4-dihydro-2H-thiochromene-4-carboxylic acid Traditional Name: 6,8-dibutylthiochroman-4-carboxylic acid Formula: C18H26O2S MolecularWeight: 306.46284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=C2C(=C1)C(CCS2)C(=O)O)CCCC

Isomeric SMILES

CCCCC1=CC(=C2C(=C1)C(CCS2)C(=O)O)CCCC

InChI

InChI=1S/C18H26O2S/c1-3-5-7-13-11-14(8-6-4-2)17-16(12-13)15(18(19)20)9-10-21-17/h11-12,15H,3-10H2,1-2H3,(H,19,20)