propyl 3,4-dimethylbenzoate

Systemtic Name: propyl 3,4-dimethylbenzoate Openeye Name: propyl 3,4-dimethylbenzoate CAS Name: 3,4-dimethylbenzoic acid propyl ester IUPAC Name: propyl 3,4-dimethylbenzoate Traditional Name: 3,4-dimethylbenzoic acid propyl ester Formula: C12H16O2 MolecularWeight: 192.25424

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=C(C=C1)C)C

Isomeric SMILES

CCCOC(=O)C1=CC(=C(C=C1)C)C

InChI

InChI=1S/C12H16O2/c1-4-7-14-12(13)11-6-5-9(2)10(3)8-11/h5-6,8H,4,7H2,1-3H3