(4-cyano-2-methoxy-phenyl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: (4-cyano-2-methoxy-phenyl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: (4-cyano-2-methoxy-phenyl) 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid (4-cyano-2-methoxyphenyl) ester IUPAC Name: (4-cyano-2-methoxyphenyl) 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid (4-cyano-2-methoxy-phenyl) ester Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C#N)OC(=O)C2=CC3=C(S2)CCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)C#N)OC(=O)C2=CC3=C(S2)CCCC3

InChI

InChI=1S/C17H15NO3S/c1-20-14-8-11(10-18)6-7-13(14)21-17(19)16-9-12-4-2-3-5-15(12)22-16/h6-9H,2-5H2,1H3