butan-2-yl 4-methylbenzoate

Systemtic Name: butan-2-yl 4-methylbenzoate Openeye Name: sec-butyl 4-methylbenzoate CAS Name: 4-methylbenzoic acid butan-2-yl ester IUPAC Name: butan-2-yl 4-methylbenzoate Traditional Name: 4-methylbenzoic acid sec-butyl ester Formula: C12H16O2 MolecularWeight: 192.25424

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCC(C)OC(=O)C1=CC=C(C=C1)C

InChI

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