2-methylpropyl 4-butylbenzoate

Systemtic Name: 2-methylpropyl 4-butylbenzoate Openeye Name: isobutyl 4-butylbenzoate CAS Name: 4-butylbenzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-butylbenzoate Traditional Name: 4-butylbenzoic acid isobutyl ester Formula: C15H22O2 MolecularWeight: 234.33398

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)OCC(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)OCC(C)C

InChI

InChI=1S/C15H22O2/c1-4-5-6-13-7-9-14(10-8-13)15(16)17-11-12(2)3/h7-10,12H,4-6,11H2,1-3H3