2-(4-azanyl-2-bromanyl-phenyl)-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-(4-azanyl-2-bromanyl-phenyl)-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-(4-amino-2-bromo-phenyl)-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-(4-amino-2-bromophenyl)-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-(4-amino-2-bromophenyl)-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-(4-amino-2-bromo-phenyl)-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C14H16BrNO2 MolecularWeight: 310.18634

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C2=C(C=C(C=C2)N)Br)C

Isomeric SMILES

CC1(CC(=O)C(C(=O)C1)C2=C(C=C(C=C2)N)Br)C

InChI

InChI=1S/C14H16BrNO2/c1-14(2)6-11(17)13(12(18)7-14)9-4-3-8(16)5-10(9)15/h3-5,13H,6-7,16H2,1-2H3