2-(5-methoxy-2-benzothiophen-1-yl)-3-methyl-butanoic acid

Systemtic Name: 2-(5-methoxy-2-benzothiophen-1-yl)-3-methyl-butanoic acid Openeye Name: 2-(5-methoxy-2-benzothiophen-1-yl)-3-methyl-butanoic acid CAS Name: 2-(5-methoxy-2-benzothiophen-1-yl)-3-methylbutanoic acid IUPAC Name: 2-(5-methoxy-2-benzothiophen-1-yl)-3-methylbutanoic acid Traditional Name: 2-(5-methoxyisobenzothiophen-1-yl)-3-methyl-butyric acid Formula: C14H16O3S MolecularWeight: 264.34004

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=C2C=CC(=CC2=CS1)OC)C(=O)O

Isomeric SMILES

CC(C)C(C1=C2C=CC(=CC2=CS1)OC)C(=O)O

InChI

InChI=1S/C14H16O3S/c1-8(2)12(14(15)16)13-11-5-4-10(17-3)6-9(11)7-18-13/h4-8,12H,1-3H3,(H,15,16)