3-[2-methoxy-3-(3-methyl-1-benzothiophen-2-yl)phenyl]propanoic acid

Systemtic Name: 3-[2-methoxy-3-(3-methyl-1-benzothiophen-2-yl)phenyl]propanoic acid Openeye Name: 3-[2-methoxy-3-(3-methylbenzothiophen-2-yl)phenyl]propanoic acid CAS Name: 3-[2-methoxy-3-(3-methyl-1-benzothiophen-2-yl)phenyl]propanoic acid IUPAC Name: 3-[2-methoxy-3-(3-methyl-1-benzothiophen-2-yl)phenyl]propanoic acid Traditional Name: 3-[2-methoxy-3-(3-methylbenzothiophen-2-yl)phenyl]propionic acid Formula: C19H18O3S MolecularWeight: 326.40942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C3=C(C(=CC=C3)CCC(=O)O)OC

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C3=C(C(=CC=C3)CCC(=O)O)OC

InChI

InChI=1S/C19H18O3S/c1-12-14-7-3-4-9-16(14)23-19(12)15-8-5-6-13(18(15)22-2)10-11-17(20)21/h3-9H,10-11H2,1-2H3,(H,20,21)