methoxybenzene; [2-(4-methyl-2-oxidanyl-phenyl)oxiran-2-yl]methyl ethanoate; ethanoate

Systemtic Name: methoxybenzene; [2-(4-methyl-2-oxidanyl-phenyl)oxiran-2-yl]methyl ethanoate; ethanoate Openeye Name: anisole; [2-(2-hydroxy-4-methyl-phenyl)oxiran-2-yl]methyl acetate; acetate CAS Name: acetic acid [2-(2-hydroxy-4-methylphenyl)-2-oxiranyl]methyl ester; methoxybenzene; acetate IUPAC Name: anisole; [2-(2-hydroxy-4-methylphenyl)oxiran-2-yl]methyl acetate; acetate Traditional Name: acetic acid [2-(2-hydroxy-4-methyl-phenyl)oxiran-2-yl]methyl ester; anisole; acetate Formula: C21H25O7- MolecularWeight: 389.419

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C2(CO2)COC(=O)C)O.CC(=O)[O-].COC1=CC=CC=C1

Isomeric SMILES

CC1=CC(=C(C=C1)C2(CO2)COC(=O)C)O.CC(=O)[O-].COC1=CC=CC=C1

InChI

InChI=1S/C12H14O4.C7H8O.C2H4O2/c1-8-3-4-10(11(14)5-8)12(7-16-12)6-15-9(2)13;1-8-7-5-3-2-4-6-7;1-2(3)4/h3-5,14H,6-7H2,1-2H3;2-6H,1H3;1H3,(H,3,4)/p-1