2-bromanyl-4-(1,5,5-trimethyl-7-oxidanylidene-4,6-dihydroindazol-3-yl)benzenecarbonitrile

Systemtic Name: 2-bromanyl-4-(1,5,5-trimethyl-7-oxidanylidene-4,6-dihydroindazol-3-yl)benzenecarbonitrile Openeye Name: 2-bromo-4-(1,5,5-trimethyl-7-oxo-4,6-dihydroindazol-3-yl)benzonitrile CAS Name: 2-bromo-4-(1,5,5-trimethyl-7-oxo-4,6-dihydroindazol-3-yl)benzonitrile IUPAC Name: 2-bromo-4-(1,5,5-trimethyl-7-oxo-4,6-dihydroindazol-3-yl)benzonitrile Traditional Name: 2-bromo-4-(7-keto-1,5,5-trimethyl-4,6-dihydroindazol-3-yl)benzonitrile Formula: C17H16BrN3O MolecularWeight: 358.23244

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)N(N=C2C3=CC(=C(C=C3)C#N)Br)C)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)N(N=C2C3=CC(=C(C=C3)C#N)Br)C)C

InChI

InChI=1S/C17H16BrN3O/c1-17(2)7-12-15(20-21(3)16(12)14(22)8-17)10-4-5-11(9-19)13(18)6-10/h4-6H,7-8H2,1-3H3