methyl 2,4,5-trimethylbenzoate

Systemtic Name: methyl 2,4,5-trimethylbenzoate Openeye Name: methyl 2,4,5-trimethylbenzoate CAS Name: 2,4,5-trimethylbenzoic acid methyl ester IUPAC Name: methyl 2,4,5-trimethylbenzoate Traditional Name: 2,4,5-trimethylbenzoic acid methyl ester Formula: C11H14O2 MolecularWeight: 178.22766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)OC)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)OC)C)C

InChI

InChI=1S/C11H14O2/c1-7-5-9(3)10(6-8(7)2)11(12)13-4/h5-6H,1-4H3