3-[2-(3,4-dimethoxyphenyl)ethylamino]-5,5-dimethyl-2-(phenylcarbonyl)cyclohex-2-en-1-one

Systemtic Name: 3-[2-(3,4-dimethoxyphenyl)ethylamino]-5,5-dimethyl-2-(phenylcarbonyl)cyclohex-2-en-1-one Openeye Name: 2-benzoyl-3-[2-(3,4-dimethoxyphenyl)ethylamino]-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 2-benzoyl-3-[2-(3,4-dimethoxyphenyl)ethylamino]-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 2-benzoyl-3-[2-(3,4-dimethoxyphenyl)ethylamino]-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 2-benzoyl-3-(homoveratrylamino)-5,5-dimethyl-cyclohex-2-en-1-one Formula: C25H29NO4 MolecularWeight: 407.50206

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=C(C(=O)C1)C(=O)C2=CC=CC=C2)NCCC3=CC(=C(C=C3)OC)OC)C

Isomeric SMILES

CC1(CC(=C(C(=O)C1)C(=O)C2=CC=CC=C2)NCCC3=CC(=C(C=C3)OC)OC)C

InChI

InChI=1S/C25H29NO4/c1-25(2)15-19(23(20(27)16-25)24(28)18-8-6-5-7-9-18)26-13-12-17-10-11-21(29-3)22(14-17)30-4/h5-11,14,26H,12-13,15-16H2,1-4H3