[6-methyl-2-oxidanyl-3-[2-(phenylmethyl)oxiran-2-yl]phenyl] ethanoate ethanoate

Systemtic Name: [6-methyl-2-oxidanyl-3-[2-(phenylmethyl)oxiran-2-yl]phenyl] ethanoate ethanoate Openeye Name: [3-(2-benzyloxiran-2-yl)-2-hydroxy-6-methyl-phenyl] acetate acetate CAS Name: acetic acid [2-hydroxy-6-methyl-3-[2-(phenylmethyl)-2-oxiranyl]phenyl] ester acetate IUPAC Name: [3-(2-benzyloxiran-2-yl)-2-hydroxy-6-methylphenyl] acetate acetate Traditional Name: acetic acid [3-(2-benzyloxiran-2-yl)-2-hydroxy-6-methyl-phenyl] ester acetate Formula: C20H21O6- MolecularWeight: 357.37714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)C2(CO2)CC3=CC=CC=C3)O)OC(=O)C.CC(=O)[O-]

Isomeric SMILES

CC1=C(C(=C(C=C1)C2(CO2)CC3=CC=CC=C3)O)OC(=O)C.CC(=O)[O-]

InChI

InChI=1S/C18H18O4.C2H4O2/c1-12-8-9-15(16(20)17(12)22-13(2)19)18(11-21-18)10-14-6-4-3-5-7-14;1-2(3)4/h3-9,20H,10-11H2,1-2H3;1H3,(H,3,4)/p-1