3-[(5-bromanylpyridin-2-yl)amino]-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 3-[(5-bromanylpyridin-2-yl)amino]-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-[(5-bromo-2-pyridyl)amino]-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-[(5-bromo-2-pyridinyl)amino]-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-[(5-bromopyridin-2-yl)amino]-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-[(5-bromo-2-pyridyl)amino]-5,5-dimethyl-cyclohex-2-en-1-one Formula: C13H15BrN2O MolecularWeight: 295.175

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NC2=NC=C(C=C2)Br)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NC2=NC=C(C=C2)Br)C

InChI

InChI=1S/C13H15BrN2O/c1-13(2)6-10(5-11(17)7-13)16-12-4-3-9(14)8-15-12/h3-5,8H,6-7H2,1-2H3,(H,15,16)