2-bromanyl-3-[(4-ethanoylphenyl)amino]-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 2-bromanyl-3-[(4-ethanoylphenyl)amino]-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-(4-acetylanilino)-2-bromo-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-(4-acetylanilino)-2-bromo-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-(4-acetylanilino)-2-bromo-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-(4-acetylanilino)-2-bromo-5,5-dimethyl-cyclohex-2-en-1-one Formula: C16H18BrNO2 MolecularWeight: 336.22362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18BrNO2/c1-10(19)11-4-6-12(7-5-11)18-13-8-16(2,3)9-14(20)15(13)17/h4-7,18H,8-9H2,1-3H3