(2E,3R,6R)-3-(3-chloranylprop-1-en-2-yl)-6-methyl-2-(3-phenylmethoxypropylidene)cyclohexan-1-one

Systemtic Name: (2E,3R,6R)-3-(3-chloranylprop-1-en-2-yl)-6-methyl-2-(3-phenylmethoxypropylidene)cyclohexan-1-one Openeye Name: (2E,3R,6R)-2-(3-benzyloxypropylidene)-3-[1-(chloromethyl)vinyl]-6-methyl-cyclohexanone CAS Name: (2E,3R,6R)-3-(3-chloroprop-1-en-2-yl)-6-methyl-2-(3-phenylmethoxypropylidene)-1-cyclohexanone IUPAC Name: (2E,3R,6R)-3-(3-chloroprop-1-en-2-yl)-6-methyl-2-(3-phenylmethoxypropylidene)cyclohexan-1-one Traditional Name: (2E,3R,6R)-2-(3-benzoxypropylidene)-3-[1-(chloromethyl)vinyl]-6-methyl-cyclohexanone Formula: C20H25ClO2 MolecularWeight: 332.8643

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=CCCOCC2=CC=CC=C2)C1=O)C(=C)CCl

Isomeric SMILES

C[C@@H]1CC[C@H](/C(=C\CCOCC2=CC=CC=C2)/C1=O)C(=C)CCl

InChI

InChI=1S/C20H25ClO2/c1-15-10-11-18(16(2)13-21)19(20(15)22)9-6-12-23-14-17-7-4-3-5-8-17/h3-5,7-9,15,18H,2,6,10-14H2,1H3/b19-9+/t15-,18+/m1/s1