1-methoxy-4-methyl-benzene; 3-methyl-4-oxidanylidene-butanoic acid

Systemtic Name: 1-methoxy-4-methyl-benzene; 3-methyl-4-oxidanylidene-butanoic acid Openeye Name: 1-methoxy-4-methyl-benzene; 3-methyl-4-oxo-butanoic acid CAS Name: 1-methoxy-4-methylbenzene; 3-methyl-4-oxobutanoic acid IUPAC Name: 1-methoxy-4-methylbenzene; 3-methyl-4-oxobutanoic acid Traditional Name: 4-keto-3-methyl-butyric acid; 1-methoxy-4-methyl-benzene Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H10O.C5H8O3/c1-7-3-5-8(9-2)6-4-7;1-4(3-6)2-5(7)8/h3-6H,1-2H3;3-4H,2H2,1H3,(H,7,8)