[(5-methyl-2-oxidanyl-phenyl)-(3-oxidanylidenebutanoyloxy)methyl] 3-oxidanylidenebutanoate

Systemtic Name: [(5-methyl-2-oxidanyl-phenyl)-(3-oxidanylidenebutanoyloxy)methyl] 3-oxidanylidenebutanoate Openeye Name: [(2-hydroxy-5-methyl-phenyl)-(3-oxobutanoyloxy)methyl] 3-oxobutanoate CAS Name: 3-oxobutanoic acid [1,3-dioxobutoxy-(2-hydroxy-5-methylphenyl)methyl] ester IUPAC Name: [(2-hydroxy-5-methylphenyl)-(3-oxobutanoyloxy)methyl] 3-oxobutanoate Traditional Name: 3-ketobutyric acid [acetoacetyloxy-(2-hydroxy-5-methyl-phenyl)methyl] ester Formula: C16H18O7 MolecularWeight: 322.30992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(OC(=O)CC(=O)C)OC(=O)CC(=O)C

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(OC(=O)CC(=O)C)OC(=O)CC(=O)C

InChI

InChI=1S/C16H18O7/c1-9-4-5-13(19)12(6-9)16(22-14(20)7-10(2)17)23-15(21)8-11(3)18/h4-6,16,19H,7-8H2,1-3H3