2-ethanoyl-5,5-dimethyl-3-(phenethylamino)cyclohex-2-en-1-one

Systemtic Name: 2-ethanoyl-5,5-dimethyl-3-(phenethylamino)cyclohex-2-en-1-one Openeye Name: 2-acetyl-5,5-dimethyl-3-(phenethylamino)cyclohex-2-en-1-one CAS Name: 2-acetyl-5,5-dimethyl-3-(phenethylamino)-1-cyclohex-2-enone IUPAC Name: 2-acetyl-5,5-dimethyl-3-(phenethylamino)cyclohex-2-en-1-one Traditional Name: 2-acetyl-5,5-dimethyl-3-(phenethylamino)cyclohex-2-en-1-one Formula: C18H23NO2 MolecularWeight: 285.38072

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(CC(CC1=O)(C)C)NCCC2=CC=CC=C2

Isomeric SMILES

CC(=O)C1=C(CC(CC1=O)(C)C)NCCC2=CC=CC=C2

InChI

InChI=1S/C18H23NO2/c1-13(20)17-15(11-18(2,3)12-16(17)21)19-10-9-14-7-5-4-6-8-14/h4-8,19H,9-12H2,1-3H3