4-(3,4-dimethylphenyl)butanoate

Systemtic Name: 4-(3,4-dimethylphenyl)butanoate Openeye Name: 4-(3,4-dimethylphenyl)butanoate CAS Name: 4-(3,4-dimethylphenyl)butanoate IUPAC Name: 4-(3,4-dimethylphenyl)butanoate Traditional Name: 4-(3,4-dimethylphenyl)butyrate Formula: C12H15O2- MolecularWeight: 191.2463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCCC(=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)CCCC(=O)[O-])C

InChI

InChI=1S/C12H16O2/c1-9-6-7-11(8-10(9)2)4-3-5-12(13)14/h6-8H,3-5H2,1-2H3,(H,13,14)/p-1