(1-butanoyloxy-2,2,4-trimethyl-pentan-3-yl) benzoate

Systemtic Name: (1-butanoyloxy-2,2,4-trimethyl-pentan-3-yl) benzoate Openeye Name: (3-butanoyloxy-1-isopropyl-2,2-dimethyl-propyl) benzoate CAS Name: benzoic acid [2,2,4-trimethyl-1-(1-oxobutoxy)pentan-3-yl] ester IUPAC Name: (1-butanoyloxy-2,2,4-trimethylpentan-3-yl) benzoate Traditional Name: benzoic acid (3-butyryloxy-1-isopropyl-2,2-dimethyl-propyl) ester Formula: C19H28O4 MolecularWeight: 320.42322

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OCC(C)(C)C(C(C)C)OC(=O)C1=CC=CC=C1

Isomeric SMILES

CCCC(=O)OCC(C)(C)C(C(C)C)OC(=O)C1=CC=CC=C1

InChI

InChI=1S/C19H28O4/c1-6-10-16(20)22-13-19(4,5)17(14(2)3)23-18(21)15-11-8-7-9-12-15/h7-9,11-12,14,17H,6,10,13H2,1-5H3