3-phenylpropyl 3-(4-tert-butylphenyl)carbonyloxybenzoate

Systemtic Name: 3-phenylpropyl 3-(4-tert-butylphenyl)carbonyloxybenzoate Openeye Name: 3-phenylpropyl 3-(4-tert-butylbenzoyl)oxybenzoate CAS Name: 3-[(4-tert-butylphenyl)-oxomethoxy]benzoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 3-(4-tert-butylbenzoyl)oxybenzoate Traditional Name: 3-(4-tert-butylbenzoyl)oxybenzoic acid 3-phenylpropyl ester Formula: C27H28O4 MolecularWeight: 416.50882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCCC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OC2=CC=CC(=C2)C(=O)OCCCC3=CC=CC=C3

InChI

InChI=1S/C27H28O4/c1-27(2,3)23-16-14-21(15-17-23)26(29)31-24-13-7-12-22(19-24)25(28)30-18-8-11-20-9-5-4-6-10-20/h4-7,9-10,12-17,19H,8,11,18H2,1-3H3