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methyl benzo[b][1,4]benzothiazepine-9-carboxylate

methyl benzo[b][1,4]benzothiazepine-9-carboxylate

Systemtic Name:methyl benzo[b][1,4]benzothiazepine-9-carboxylate
Openeye Name:methyl benzo[b][1,4]benzothiazepine-9-carboxylate
CAS Name:9-benzo[b][1,4]benzothiazepinecarboxylic acid methyl ester
IUPAC Name:methyl benzo[b][1,4]benzothiazepine-9-carboxylate
Traditional Name:benzo[b][1,4]benzothiazepine-9-carboxylic acid methyl ester
Formula: C15H11NO2S
MolecularWeight: 269.31834
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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C=NC3=CC=CC=C3S2


Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C=NC3=CC=CC=C3S2


InChI

InChI=1S/C15H11NO2S/c1-18-15(17)10-6-7-11-9-16-12-4-2-3-5-13(12)19-14(11)8-10/h2-9H,1H3


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