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

Systemtic Name: 2-butanoyl-5,5-dimethyl-3-[(phenylmethyl)amino]cyclohex-2-en-1-one Openeye Name: 3-(benzylamino)-2-butanoyl-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 5,5-dimethyl-2-(1-oxobutyl)-3-[(phenylmethyl)amino]-1-cyclohex-2-enone IUPAC Name: 3-(benzylamino)-2-butanoyl-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 3-(benzylamino)-2-butyryl-5,5-dimethyl-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)NCC2=CC=CC=C2

Isomeric SMILES

CCCC(=O)C1=C(CC(CC1=O)(C)C)NCC2=CC=CC=C2

InChI

InChI=1S/C19H25NO2/c1-4-8-16(21)18-15(11-19(2,3)12-17(18)22)20-13-14-9-6-5-7-10-14/h5-7,9-10,20H,4,8,11-13H2,1-3H3