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

Systemtic Name: 2-ethanoyl-5,5-dimethyl-3-[(phenylmethyl)amino]cyclohex-2-en-1-one Openeye Name: 2-acetyl-3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 2-acetyl-5,5-dimethyl-3-[(phenylmethyl)amino]-1-cyclohex-2-enone IUPAC Name: 2-acetyl-3-(benzylamino)-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 2-acetyl-3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO2/c1-12(19)16-14(9-17(2,3)10-15(16)20)18-11-13-7-5-4-6-8-13/h4-8,18H,9-11H2,1-3H3