4-(2,3-dimethylphenyl)-4-oxidanyl-butanoate

Systemtic Name: 4-(2,3-dimethylphenyl)-4-oxidanyl-butanoate Openeye Name: 4-(2,3-dimethylphenyl)-4-hydroxy-butanoate CAS Name: 4-(2,3-dimethylphenyl)-4-hydroxybutanoate IUPAC Name: 4-(2,3-dimethylphenyl)-4-hydroxybutanoate Traditional Name: 4-(2,3-dimethylphenyl)-4-hydroxy-butyrate Formula: C12H15O3- MolecularWeight: 207.2457

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C(CCC(=O)[O-])O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C(CCC(=O)[O-])O)C

InChI

InChI=1S/C12H16O3/c1-8-4-3-5-10(9(8)2)11(13)6-7-12(14)15/h3-5,11,13H,6-7H2,1-2H3,(H,14,15)/p-1