5,5-dimethyl-2-[(E)-3-(phenethylamino)prop-2-enoyl]cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-[(E)-3-(phenethylamino)prop-2-enoyl]cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-[(E)-3-(phenethylamino)prop-2-enoyl]cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-[(E)-1-oxo-3-(phenethylamino)prop-2-enyl]cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-[(E)-3-(phenethylamino)prop-2-enoyl]cyclohexane-1,3-dione Traditional Name: 5,5-dimethyl-2-[(E)-3-(phenethylamino)acryloyl]cyclohexane-1,3-quinone Formula: C19H23NO3 MolecularWeight: 313.39082

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C(=O)C=CNCCC2=CC=CC=C2)C

Isomeric SMILES

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

InChI

InChI=1S/C19H23NO3/c1-19(2)12-16(22)18(17(23)13-19)15(21)9-11-20-10-8-14-6-4-3-5-7-14/h3-7,9,11,18,20H,8,10,12-13H2,1-2H3/b11-9+