methyl 6-oxidanylidenepyrrolo[1,2-a][3,1]benzothiazepine-5-carboxylate

Systemtic Name: methyl 6-oxidanylidenepyrrolo[1,2-a][3,1]benzothiazepine-5-carboxylate Openeye Name: methyl 6-oxopyrrolo[1,2-a][3,1]benzothiazepine-5-carboxylate CAS Name: 6-oxo-5-pyrrolo[1,2-a][3,1]benzothiazepinecarboxylic acid methyl ester IUPAC Name: methyl 6-oxopyrrolo[1,2-a][3,1]benzothiazepine-5-carboxylate Traditional Name: 6-ketopyrrolo[1,2-a][3,1]benzothiazepine-5-carboxylic acid methyl ester Formula: C14H11NO3S MolecularWeight: 273.30704

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1C(=O)C2=CC=CC=C2N3C=CC=C3S1

Isomeric SMILES

COC(=O)C1C(=O)C2=CC=CC=C2N3C=CC=C3S1

InChI

InChI=1S/C14H11NO3S/c1-18-14(17)13-12(16)9-5-2-3-6-10(9)15-8-4-7-11(15)19-13/h2-8,13H,1H3