(6-chloranylpyridin-3-yl)methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate

Systemtic Name: (6-chloranylpyridin-3-yl)methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate Openeye Name: (6-chloro-3-pyridyl)methyl 6-methyl-2,3-dihydrobenzothiophene-2-carboxylate CAS Name: 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylic acid (6-chloro-3-pyridinyl)methyl ester IUPAC Name: (6-chloropyridin-3-yl)methyl 6-methyl-2,3-dihydro-1-benzothiophene-2-carboxylate Traditional Name: 6-methyl-2,3-dihydrobenzothiophene-2-carboxylic acid (6-chloro-3-pyridyl)methyl ester Formula: C16H14ClNO2S MolecularWeight: 319.80586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(S2)C(=O)OCC3=CN=C(C=C3)Cl)C=C1

Isomeric SMILES

CC1=CC2=C(CC(S2)C(=O)OCC3=CN=C(C=C3)Cl)C=C1

InChI

InChI=1S/C16H14ClNO2S/c1-10-2-4-12-7-14(21-13(12)6-10)16(19)20-9-11-3-5-15(17)18-8-11/h2-6,8,14H,7,9H2,1H3