[5-bromanyl-4-methoxy-2-[[(1S)-3,6,6-trimethyl-2-methylidene-cyclohex-3-en-1-yl]methyl]phenyl] ethanoate

Systemtic Name: [5-bromanyl-4-methoxy-2-[[(1S)-3,6,6-trimethyl-2-methylidene-cyclohex-3-en-1-yl]methyl]phenyl] ethanoate Openeye Name: [5-bromo-4-methoxy-2-[[(1S)-3,6,6-trimethyl-2-methylene-cyclohex-3-en-1-yl]methyl]phenyl] acetate CAS Name: acetic acid [5-bromo-4-methoxy-2-[[(1S)-3,6,6-trimethyl-2-methylene-1-cyclohex-3-enyl]methyl]phenyl] ester IUPAC Name: [5-bromo-4-methoxy-2-[[(1S)-3,6,6-trimethyl-2-methylidenecyclohex-3-en-1-yl]methyl]phenyl] acetate Traditional Name: acetic acid [5-bromo-4-methoxy-2-[[(1S)-3,6,6-trimethyl-2-methylene-cyclohex-3-en-1-yl]methyl]phenyl] ester Formula: C20H25BrO3 MolecularWeight: 393.3147

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CCC(C(C1=C)CC2=CC(=C(C=C2OC(=O)C)Br)OC)(C)C

Isomeric SMILES

CC1=CCC([C@@H](C1=C)CC2=CC(=C(C=C2OC(=O)C)Br)OC)(C)C

InChI

InChI=1S/C20H25BrO3/c1-12-7-8-20(4,5)16(13(12)2)9-15-10-19(23-6)17(21)11-18(15)24-14(3)22/h7,10-11,16H,2,8-9H2,1,3-6H3/t16-/m1/s1