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

Systemtic Name: 5,5-dimethyl-3-[(phenylmethyl)amino]-2-prop-2-enyl-cyclohex-2-en-1-one Openeye Name: 2-allyl-3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 5,5-dimethyl-3-[(phenylmethyl)amino]-2-prop-2-enyl-1-cyclohex-2-enone IUPAC Name: 3-(benzylamino)-5,5-dimethyl-2-prop-2-enylcyclohex-2-en-1-one Traditional Name: 2-allyl-3-(benzylamino)-5,5-dimethyl-cyclohex-2-en-1-one Formula: C18H23NO MolecularWeight: 269.38132

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23NO/c1-4-8-15-16(11-18(2,3)12-17(15)20)19-13-14-9-6-5-7-10-14/h4-7,9-10,19H,1,8,11-13H2,2-3H3