3-(hexylamino)-5,5-dimethyl-2-(phenylcarbonyl)cyclohex-2-en-1-one

Systemtic Name: 3-(hexylamino)-5,5-dimethyl-2-(phenylcarbonyl)cyclohex-2-en-1-one Openeye Name: 2-benzoyl-3-(hexylamino)-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 2-benzoyl-3-(hexylamino)-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 2-benzoyl-3-(hexylamino)-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 2-benzoyl-3-(hexylamino)-5,5-dimethyl-cyclohex-2-en-1-one Formula: C21H29NO2 MolecularWeight: 327.46046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC1=C(C(=O)CC(C1)(C)C)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCNC1=C(C(=O)CC(C1)(C)C)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H29NO2/c1-4-5-6-10-13-22-17-14-21(2,3)15-18(23)19(17)20(24)16-11-8-7-9-12-16/h7-9,11-12,22H,4-6,10,13-15H2,1-3H3