5-(4-bromanyl-1H-indol-3-yl)-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one

Systemtic Name: 5-(4-bromanyl-1H-indol-3-yl)-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one Openeye Name: 5-(4-bromo-1H-indol-3-yl)-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one CAS Name: 5-(4-bromo-1H-indol-3-yl)-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one IUPAC Name: 5-(4-bromo-1H-indol-3-yl)-3,4,5,10-tetrahydro-2H-azepino[3,4-b]indol-1-one Traditional Name: 5-(4-bromo-1H-indol-3-yl)-3,4,5,10-tetrahydro-2H-azepin[3,4-b]indol-1-one Formula: C20H16BrN3O MolecularWeight: 394.26454

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Descriptors Computed from Structure

Canonical SMILES:

C1CNC(=O)C2=C(C1C3=CNC4=C3C(=CC=C4)Br)C5=CC=CC=C5N2

Isomeric SMILES

C1CNC(=O)C2=C(C1C3=CNC4=C3C(=CC=C4)Br)C5=CC=CC=C5N2

InChI

InChI=1S/C20H16BrN3O/c21-14-5-3-7-16-18(14)13(10-23-16)11-8-9-22-20(25)19-17(11)12-4-1-2-6-15(12)24-19/h1-7,10-11,23-24H,8-9H2,(H,22,25)