2-(9-bromanyl-5-methyl-4-oxidanylidene-3-phenyl-pyridazino[4,5-b]indol-1-yl)ethanenitrile

Systemtic Name: 2-(9-bromanyl-5-methyl-4-oxidanylidene-3-phenyl-pyridazino[4,5-b]indol-1-yl)ethanenitrile Openeye Name: 2-(9-bromo-5-methyl-4-oxo-3-phenyl-pyridazino[4,5-b]indol-1-yl)acetonitrile CAS Name: 2-(9-bromo-5-methyl-4-oxo-3-phenyl-1-pyridazino[4,5-b]indolyl)acetonitrile IUPAC Name: 2-(9-bromo-5-methyl-4-oxo-3-phenylpyridazino[4,5-b]indol-1-yl)acetonitrile Traditional Name: 2-(9-bromo-4-keto-5-methyl-3-phenyl-pyridazin[4,5-b]indol-1-yl)acetonitrile Formula: C19H13BrN4O MolecularWeight: 393.23672

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=CC=C2)Br)C3=C1C(=O)N(N=C3CC#N)C4=CC=CC=C4

Isomeric SMILES

CN1C2=C(C(=CC=C2)Br)C3=C1C(=O)N(N=C3CC#N)C4=CC=CC=C4

InChI

InChI=1S/C19H13BrN4O/c1-23-15-9-5-8-13(20)16(15)17-14(10-11-21)22-24(19(25)18(17)23)12-6-3-2-4-7-12/h2-9H,10H2,1H3