3-[1-(phenylcarbonyloxy)ethyl]hexan-2-yl benzoate

Systemtic Name: 3-[1-(phenylcarbonyloxy)ethyl]hexan-2-yl benzoate Openeye Name: [2-(1-benzoyloxyethyl)-1-methyl-pentyl] benzoate CAS Name: benzoic acid 3-(1-benzoyloxyethyl)hexan-2-yl ester IUPAC Name: 3-(1-benzoyloxyethyl)hexan-2-yl benzoate Traditional Name: benzoic acid [2-(1-benzoyloxyethyl)-1-methyl-pentyl] ester Formula: C22H26O4 MolecularWeight: 354.43944

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(C)OC(=O)C1=CC=CC=C1)C(C)OC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCC(C(C)OC(=O)C1=CC=CC=C1)C(C)OC(=O)C2=CC=CC=C2

InChI

InChI=1S/C22H26O4/c1-4-11-20(16(2)25-21(23)18-12-7-5-8-13-18)17(3)26-22(24)19-14-9-6-10-15-19/h5-10,12-17,20H,4,11H2,1-3H3