methyl 2,3-dihydro-1-benzothiepine-4-carboxylate

Systemtic Name: methyl 2,3-dihydro-1-benzothiepine-4-carboxylate Openeye Name: methyl 2,3-dihydro-1-benzothiepine-4-carboxylate CAS Name: 2,3-dihydro-1-benzothiepin-4-carboxylic acid methyl ester IUPAC Name: methyl 2,3-dihydro-1-benzothiepine-4-carboxylate Traditional Name: 2,3-dihydro-1-benzothiepin-4-carboxylic acid methyl ester Formula: C12H12O2S MolecularWeight: 220.28748

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=CC=CC=C2SCC1

Isomeric SMILES

COC(=O)C1=CC2=CC=CC=C2SCC1

InChI

InChI=1S/C12H12O2S/c1-14-12(13)10-6-7-15-11-5-3-2-4-9(11)8-10/h2-5,8H,6-7H2,1H3