2-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-5,5-dimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-5,5-dimethyl-cyclohexane-1,3-dione Openeye Name: 2-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-[(E)-3-(4-methoxyphenyl)-1-oxoprop-2-enyl]-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-[(E)-3-(4-methoxyphenyl)acryloyl]-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C18H20O4 MolecularWeight: 300.349

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)C(C(=O)C1)C(=O)C=CC2=CC=C(C=C2)OC)C

Isomeric SMILES

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

InChI

InChI=1S/C18H20O4/c1-18(2)10-15(20)17(16(21)11-18)14(19)9-6-12-4-7-13(22-3)8-5-12/h4-9,17H,10-11H2,1-3H3/b9-6+