ethyl 2-(9-bromanyl-2,3-dimethoxy-6-oxidanylidene-5,7-dihydroindolo[3,2-d][1]benzazepin-12-yl)ethanoate

Systemtic Name: ethyl 2-(9-bromanyl-2,3-dimethoxy-6-oxidanylidene-5,7-dihydroindolo[3,2-d][1]benzazepin-12-yl)ethanoate Openeye Name: ethyl 2-(9-bromo-2,3-dimethoxy-6-oxo-5,7-dihydroindolo[3,2-d][1]benzazepin-12-yl)acetate CAS Name: 2-(9-bromo-2,3-dimethoxy-6-oxo-5,7-dihydroindolo[3,2-d][1]benzazepin-12-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-(9-bromo-2,3-dimethoxy-6-oxo-5,7-dihydroindolo[3,2-d][1]benzazepin-12-yl)acetate Traditional Name: 2-(9-bromo-6-keto-2,3-dimethoxy-5,7-dihydroindolo[3,2-d][1]benzazepin-12-yl)acetic acid ethyl ester Formula: C22H21BrN2O5 MolecularWeight: 473.31654

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)Br)C3=C1C4=CC(=C(C=C4NC(=O)C3)OC)OC

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)Br)C3=C1C4=CC(=C(C=C4NC(=O)C3)OC)OC

InChI

InChI=1S/C22H21BrN2O5/c1-4-30-21(27)11-25-17-6-5-12(23)7-13(17)14-9-20(26)24-16-10-19(29-3)18(28-2)8-15(16)22(14)25/h5-8,10H,4,9,11H2,1-3H3,(H,24,26)