3-phenylpropyl 4-(2,2-dimethylpropanoyloxy)benzoate

Systemtic Name: 3-phenylpropyl 4-(2,2-dimethylpropanoyloxy)benzoate Openeye Name: 3-phenylpropyl 4-(2,2-dimethylpropanoyloxy)benzoate CAS Name: 4-(2,2-dimethyl-1-oxopropoxy)benzoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 4-(2,2-dimethylpropanoyloxy)benzoate Traditional Name: 4-pivaloyloxybenzoic acid 3-phenylpropyl ester Formula: C21H24O4 MolecularWeight: 340.41286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC=C(C=C1)C(=O)OCCCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC=C(C=C1)C(=O)OCCCC2=CC=CC=C2

InChI

InChI=1S/C21H24O4/c1-21(2,3)20(23)25-18-13-11-17(12-14-18)19(22)24-15-7-10-16-8-5-4-6-9-16/h4-6,8-9,11-14H,7,10,15H2,1-3H3