[3-butyl-4-[2-(phenylcarbonyloxy)ethyl]octyl] benzoate

Systemtic Name: [3-butyl-4-[2-(phenylcarbonyloxy)ethyl]octyl] benzoate Openeye Name: [4-(2-benzoyloxyethyl)-3-butyl-octyl] benzoate CAS Name: benzoic acid [4-(2-benzoyloxyethyl)-3-butyloctyl] ester IUPAC Name: [4-(2-benzoyloxyethyl)-3-butyloctyl] benzoate Traditional Name: benzoic acid [4-(2-benzoyloxyethyl)-3-butyl-octyl] ester Formula: C28H38O4 MolecularWeight: 438.59892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CCOC(=O)C1=CC=CC=C1)C(CCCC)CCOC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCC(CCOC(=O)C1=CC=CC=C1)C(CCCC)CCOC(=O)C2=CC=CC=C2

InChI

InChI=1S/C28H38O4/c1-3-5-13-23(19-21-31-27(29)25-15-9-7-10-16-25)24(14-6-4-2)20-22-32-28(30)26-17-11-8-12-18-26/h7-12,15-18,23-24H,3-6,13-14,19-22H2,1-2H3