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

Systemtic Name: 3-[(4-bromophenyl)amino]-2-butanoyl-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-(4-bromoanilino)-2-butanoyl-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-(4-bromoanilino)-5,5-dimethyl-2-(1-oxobutyl)-1-cyclohex-2-enone IUPAC Name: 3-(4-bromoanilino)-2-butanoyl-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-(4-bromoanilino)-2-butyryl-5,5-dimethyl-cyclohex-2-en-1-one Formula: C18H22BrNO2 MolecularWeight: 364.27678

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22BrNO2/c1-4-5-15(21)17-14(10-18(2,3)11-16(17)22)20-13-8-6-12(19)7-9-13/h6-9,20H,4-5,10-11H2,1-3H3