N-(3-azanylpropyl)-2-(9-bromanyl-6-oxidanylidene-7,12-dihydroindolo[3,2-d][1]benzazepin-5-yl)ethanamide

Systemtic Name: N-(3-azanylpropyl)-2-(9-bromanyl-6-oxidanylidene-7,12-dihydroindolo[3,2-d][1]benzazepin-5-yl)ethanamide Openeye Name: N-(3-aminopropyl)-2-(9-bromo-6-oxo-7,12-dihydroindolo[3,2-d][1]benzazepin-5-yl)acetamide CAS Name: N-(3-aminopropyl)-2-(9-bromo-6-oxo-7,12-dihydroindolo[3,2-d][1]benzazepin-5-yl)acetamide IUPAC Name: N-(3-aminopropyl)-2-(9-bromo-6-oxo-7,12-dihydroindolo[3,2-d][1]benzazepin-5-yl)acetamide Traditional Name: N-(3-aminopropyl)-2-(9-bromo-6-keto-7,12-dihydroindolo[3,2-d][1]benzazepin-5-yl)acetamide Formula: C21H21BrN4O2 MolecularWeight: 441.32104

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(C3=CC=CC=C3N(C1=O)CC(=O)NCCCN)NC4=C2C=C(C=C4)Br

Isomeric SMILES

C1C2=C(C3=CC=CC=C3N(C1=O)CC(=O)NCCCN)NC4=C2C=C(C=C4)Br

InChI

InChI=1S/C21H21BrN4O2/c22-13-6-7-17-15(10-13)16-11-20(28)26(12-19(27)24-9-3-8-23)18-5-2-1-4-14(18)21(16)25-17/h1-2,4-7,10,25H,3,8-9,11-12,23H2,(H,24,27)