2-(7-azanylidene-2-methyl-5H-pyrrolo[3,4-b]pyridin-6-yl)-1-(3-cyclohexyl-5-methyl-4-oxidanyl-phenyl)ethanone hydrobromide

Systemtic Name: 2-(7-azanylidene-2-methyl-5H-pyrrolo[3,4-b]pyridin-6-yl)-1-(3-cyclohexyl-5-methyl-4-oxidanyl-phenyl)ethanone hydrobromide Openeye Name: 1-(3-cyclohexyl-4-hydroxy-5-methyl-phenyl)-2-(7-imino-2-methyl-5H-pyrrolo[3,4-b]pyridin-6-yl)ethanone hydrobromide CAS Name: 1-(3-cyclohexyl-4-hydroxy-5-methylphenyl)-2-(7-imino-2-methyl-5H-pyrrolo[3,4-b]pyridin-6-yl)ethanone hydrobromide IUPAC Name: 1-(3-cyclohexyl-4-hydroxy-5-methylphenyl)-2-(7-imino-2-methyl-5H-pyrrolo[3,4-b]pyridin-6-yl)ethanone hydrobromide Traditional Name: 1-(3-cyclohexyl-4-hydroxy-5-methyl-phenyl)-2-(7-imino-2-methyl-5H-pyrrolo[3,4-b]pyridin-6-yl)ethanone hydrobromide Formula: C23H28BrN3O2 MolecularWeight: 458.39132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(CN(C2=N)CC(=O)C3=CC(=C(C(=C3)C)O)C4CCCCC4)C=C1.Br

Isomeric SMILES

CC1=NC2=C(CN(C2=N)CC(=O)C3=CC(=C(C(=C3)C)O)C4CCCCC4)C=C1.Br

InChI

InChI=1S/C23H27N3O2.BrH/c1-14-10-18(11-19(22(14)28)16-6-4-3-5-7-16)20(27)13-26-12-17-9-8-15(2)25-21(17)23(26)24;/h8-11,16,24,28H,3-7,12-13H2,1-2H3;1H