3-[[3-(1-benzothiophen-2-yl)phenoxy]methyl]-5-methyl-2-oxidanyl-benzoic acid

Systemtic Name: 3-[[3-(1-benzothiophen-2-yl)phenoxy]methyl]-5-methyl-2-oxidanyl-benzoic acid Openeye Name: 3-[[3-(benzothiophen-2-yl)phenoxy]methyl]-2-hydroxy-5-methyl-benzoic acid CAS Name: 3-[[3-(1-benzothiophen-2-yl)phenoxy]methyl]-2-hydroxy-5-methylbenzoic acid IUPAC Name: 3-[[3-(1-benzothiophen-2-yl)phenoxy]methyl]-2-hydroxy-5-methylbenzoic acid Traditional Name: 3-[[3-(benzothiophen-2-yl)phenoxy]methyl]-2-hydroxy-5-methyl-benzoic acid Formula: C23H18O4S MolecularWeight: 390.45162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)O)O)COC2=CC=CC(=C2)C3=CC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)O)O)COC2=CC=CC(=C2)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C23H18O4S/c1-14-9-17(22(24)19(10-14)23(25)26)13-27-18-7-4-6-15(11-18)21-12-16-5-2-3-8-20(16)28-21/h2-12,24H,13H2,1H3,(H,25,26)