methyl 5-(phenylmethyl)-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 5-(phenylmethyl)-1-benzothiophene-3-carboxylate Openeye Name: methyl 5-benzylbenzothiophene-3-carboxylate CAS Name: 5-(phenylmethyl)-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 5-benzyl-1-benzothiophene-3-carboxylate Traditional Name: 5-benzylbenzothiophene-3-carboxylic acid methyl ester Formula: C17H14O2S MolecularWeight: 282.35686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CSC2=C1C=C(C=C2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CSC2=C1C=C(C=C2)CC3=CC=CC=C3

InChI

InChI=1S/C17H14O2S/c1-19-17(18)15-11-20-16-8-7-13(10-14(15)16)9-12-5-3-2-4-6-12/h2-8,10-11H,9H2,1H3