(3-methylphenyl) 3-chloranyl-5-methoxy-1-benzothiophene-2-carboxylate

Systemtic Name: (3-methylphenyl) 3-chloranyl-5-methoxy-1-benzothiophene-2-carboxylate Openeye Name: m-tolyl 3-chloro-5-methoxy-benzothiophene-2-carboxylate CAS Name: 3-chloro-5-methoxy-1-benzothiophene-2-carboxylic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 3-chloro-5-methoxy-1-benzothiophene-2-carboxylate Traditional Name: 3-chloro-5-methoxy-benzothiophene-2-carboxylic acid m-tolyl ester Formula: C17H13ClO3S MolecularWeight: 332.80132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)C2=C(C3=C(S2)C=CC(=C3)OC)Cl

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)C2=C(C3=C(S2)C=CC(=C3)OC)Cl

InChI

InChI=1S/C17H13ClO3S/c1-10-4-3-5-12(8-10)21-17(19)16-15(18)13-9-11(20-2)6-7-14(13)22-16/h3-9H,1-2H3