methyl 11-methoxy-6,11-dihydrobenzo[c][1]benzothiepine-2-carboxylate

Systemtic Name: methyl 11-methoxy-6,11-dihydrobenzo[c][1]benzothiepine-2-carboxylate Openeye Name: methyl 11-methoxy-6,11-dihydrobenzo[c][1]benzothiepine-2-carboxylate CAS Name: 11-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-2-carboxylic acid methyl ester IUPAC Name: methyl 11-methoxy-6,11-dihydrobenzo[c][1]benzothiepine-2-carboxylate Traditional Name: 11-methoxy-6,11-dihydrobenzo[c][1]benzothiepin-2-carboxylic acid methyl ester Formula: C17H16O3S MolecularWeight: 300.37214

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Descriptors Computed from Structure

Canonical SMILES:

COC1C2=CC=CC=C2CSC3=C1C=C(C=C3)C(=O)OC

Isomeric SMILES

COC1C2=CC=CC=C2CSC3=C1C=C(C=C3)C(=O)OC

InChI

InChI=1S/C17H16O3S/c1-19-16-13-6-4-3-5-12(13)10-21-15-8-7-11(9-14(15)16)17(18)20-2/h3-9,16H,10H2,1-2H3