4-[3-(4-chlorophenyl)-3-methyl-butyl]-3-methyl-2-prop-2-enyl-cyclopent-2-en-1-one

Systemtic Name: 4-[3-(4-chlorophenyl)-3-methyl-butyl]-3-methyl-2-prop-2-enyl-cyclopent-2-en-1-one Openeye Name: 2-allyl-4-[3-(4-chlorophenyl)-3-methyl-butyl]-3-methyl-cyclopent-2-en-1-one CAS Name: 4-[3-(4-chlorophenyl)-3-methylbutyl]-3-methyl-2-prop-2-enyl-1-cyclopent-2-enone IUPAC Name: 4-[3-(4-chlorophenyl)-3-methylbutyl]-3-methyl-2-prop-2-enylcyclopent-2-en-1-one Traditional Name: 2-allyl-4-[3-(4-chlorophenyl)-3-methyl-butyl]-3-methyl-cyclopent-2-en-1-one Formula: C20H25ClO MolecularWeight: 316.8649

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)CC1CCC(C)(C)C2=CC=C(C=C2)Cl)CC=C

Isomeric SMILES

CC1=C(C(=O)CC1CCC(C)(C)C2=CC=C(C=C2)Cl)CC=C

InChI

InChI=1S/C20H25ClO/c1-5-6-18-14(2)15(13-19(18)22)11-12-20(3,4)16-7-9-17(21)10-8-16/h5,7-10,15H,1,6,11-13H2,2-4H3