(2-cyanophenyl)methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate

Systemtic Name: (2-cyanophenyl)methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Openeye Name: (2-cyanophenyl)methyl 4,5,6,7-tetrahydrobenzothiophene-2-carboxylate CAS Name: 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 4,5,6,7-tetrahydro-1-benzothiophene-2-carboxylate Traditional Name: 4,5,6,7-tetrahydrobenzothiophene-2-carboxylic acid (2-cyanobenzyl) ester Formula: C17H15NO2S MolecularWeight: 297.3715

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C=C(S2)C(=O)OCC3=CC=CC=C3C#N

Isomeric SMILES

C1CCC2=C(C1)C=C(S2)C(=O)OCC3=CC=CC=C3C#N

InChI

InChI=1S/C17H15NO2S/c18-10-13-6-1-2-7-14(13)11-20-17(19)16-9-12-5-3-4-8-15(12)21-16/h1-2,6-7,9H,3-5,8,11H2