ethyl 2-acetyloxy-3-bromanyl-9,9-dimethyl-6-methylimino-7-oxidanylidene-10,12-dihydro-8H-indolo[2,1-c][1,4]benzothiazepine-13-carboxylate

Systemtic Name: ethyl 2-acetyloxy-3-bromanyl-9,9-dimethyl-6-methylimino-7-oxidanylidene-10,12-dihydro-8H-indolo[2,1-c][1,4]benzothiazepine-13-carboxylate Openeye Name: ethyl 2-acetoxy-3-bromo-9,9-dimethyl-6-methylimino-7-oxo-10,12-dihydro-8H-indolo[2,1-c][1,4]benzothiazepine-13-carboxylate CAS Name: 2-acetyloxy-3-bromo-9,9-dimethyl-6-methylimino-7-oxo-10,12-dihydro-8H-indolo[2,1-c][1,4]benzothiazepine-13-carboxylic acid ethyl ester IUPAC Name: ethyl 2-acetyloxy-3-bromo-9,9-dimethyl-6-methylimino-7-oxo-10,12-dihydro-8H-indolo[2,1-c][1,4]benzothiazepine-13-carboxylate Traditional Name: 2-acetoxy-3-bromo-7-keto-9,9-dimethyl-6-methylimino-10,12-dihydro-8H-indolo[2,1-c][1,4]benzothiazepine-13-carboxylic acid ethyl ester Formula: C24H25BrN2O5S MolecularWeight: 533.4347

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CSC3=C(C(=O)CC(C3)(C)C)C(=NC)N2C4=CC(=C(C=C41)OC(=O)C)Br

Isomeric SMILES

CCOC(=O)C1=C2CSC3=C(C(=O)CC(C3)(C)C)C(=NC)N2C4=CC(=C(C=C41)OC(=O)C)Br

InChI

InChI=1S/C24H25BrN2O5S/c1-6-31-23(30)20-13-7-18(32-12(2)28)14(25)8-15(13)27-16(20)11-33-19-10-24(3,4)9-17(29)21(19)22(27)26-5/h7-8H,6,9-11H2,1-5H3