4-(3-methyl-1-benzothiophen-5-yl)benzoic acid

Systemtic Name: 4-(3-methyl-1-benzothiophen-5-yl)benzoic acid Openeye Name: 4-(3-methylbenzothiophen-5-yl)benzoic acid CAS Name: 4-(3-methyl-1-benzothiophen-5-yl)benzoic acid IUPAC Name: 4-(3-methyl-1-benzothiophen-5-yl)benzoic acid Traditional Name: 4-(3-methylbenzothiophen-5-yl)benzoic acid Formula: C16H12O2S MolecularWeight: 268.33028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC2=C1C=C(C=C2)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CSC2=C1C=C(C=C2)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C16H12O2S/c1-10-9-19-15-7-6-13(8-14(10)15)11-2-4-12(5-3-11)16(17)18/h2-9H,1H3,(H,17,18)