6-bromanyl-4-phenylmethoxy-3-(1,2,2-trimethylcyclopentyl)cyclohex-2-en-1-one

Systemtic Name: 6-bromanyl-4-phenylmethoxy-3-(1,2,2-trimethylcyclopentyl)cyclohex-2-en-1-one Openeye Name: 4-benzyloxy-6-bromo-3-(1,2,2-trimethylcyclopentyl)cyclohex-2-en-1-one CAS Name: 6-bromo-4-phenylmethoxy-3-(1,2,2-trimethylcyclopentyl)-1-cyclohex-2-enone IUPAC Name: 6-bromo-4-phenylmethoxy-3-(1,2,2-trimethylcyclopentyl)cyclohex-2-en-1-one Traditional Name: 4-benzoxy-6-bromo-3-(1,2,2-trimethylcyclopentyl)cyclohex-2-en-1-one Formula: C21H27BrO2 MolecularWeight: 391.34188

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCCC1(C)C2=CC(=O)C(CC2OCC3=CC=CC=C3)Br)C

Isomeric SMILES

CC1(CCCC1(C)C2=CC(=O)C(CC2OCC3=CC=CC=C3)Br)C

InChI

InChI=1S/C21H27BrO2/c1-20(2)10-7-11-21(20,3)16-12-18(23)17(22)13-19(16)24-14-15-8-5-4-6-9-15/h4-6,8-9,12,17,19H,7,10-11,13-14H2,1-3H3