butyl benzoate; 3-methylbutyl benzoate

Systemtic Name: butyl benzoate; 3-methylbutyl benzoate Openeye Name: butyl benzoate; isopentyl benzoate CAS Name: benzoic acid butyl ester; benzoic acid 3-methylbutyl ester IUPAC Name: butyl benzoate; 3-methylbutyl benzoate Traditional Name: benzoic acid butyl ester; benzoic acid isoamyl ester Formula: C23H30O4 MolecularWeight: 370.4819

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=CC=C1.CC(C)CCOC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCCOC(=O)C1=CC=CC=C1.CC(C)CCOC(=O)C1=CC=CC=C1

InChI

InChI=1S/C12H16O2.C11H14O2/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11;1-2-3-9-13-11(12)10-7-5-4-6-8-10/h3-7,10H,8-9H2,1-2H3;4-8H,2-3,9H2,1H3