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

Systemtic Name: 2-butanoyl-5,5-dimethyl-3-[(4-methylphenyl)amino]cyclohex-2-en-1-one Openeye Name: 2-butanoyl-5,5-dimethyl-3-(4-methylanilino)cyclohex-2-en-1-one CAS Name: 5,5-dimethyl-3-(4-methylanilino)-2-(1-oxobutyl)-1-cyclohex-2-enone IUPAC Name: 2-butanoyl-5,5-dimethyl-3-(4-methylanilino)cyclohex-2-en-1-one Traditional Name: 2-butyryl-5,5-dimethyl-3-(p-toluidino)cyclohex-2-en-1-one Formula: C19H25NO2 MolecularWeight: 299.4073

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25NO2/c1-5-6-16(21)18-15(11-19(3,4)12-17(18)22)20-14-9-7-13(2)8-10-14/h7-10,20H,5-6,11-12H2,1-4H3