pentyl 2-methylbenzoate

Systemtic Name: pentyl 2-methylbenzoate Openeye Name: pentyl 2-methylbenzoate CAS Name: 2-methylbenzoic acid pentyl ester IUPAC Name: pentyl 2-methylbenzoate Traditional Name: 2-methylbenzoic acid amyl ester Formula: C13H18O2 MolecularWeight: 206.28082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=CC=C1C

Isomeric SMILES

CCCCCOC(=O)C1=CC=CC=C1C

InChI

InChI=1S/C13H18O2/c1-3-4-7-10-15-13(14)12-9-6-5-8-11(12)2/h5-6,8-9H,3-4,7,10H2,1-2H3