2-(1-benzofuran-2-yl)ethyl 4-tert-butylbenzoate

Systemtic Name: 2-(1-benzofuran-2-yl)ethyl 4-tert-butylbenzoate Openeye Name: 2-(benzofuran-2-yl)ethyl 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid 2-(2-benzofuranyl)ethyl ester IUPAC Name: 2-(1-benzofuran-2-yl)ethyl 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid 2-(benzofuran-2-yl)ethyl ester Formula: C21H22O3 MolecularWeight: 322.39758

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)OCCC2=CC3=CC=CC=C3O2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)OCCC2=CC3=CC=CC=C3O2

InChI

InChI=1S/C21H22O3/c1-21(2,3)17-10-8-15(9-11-17)20(22)23-13-12-18-14-16-6-4-5-7-19(16)24-18/h4-11,14H,12-13H2,1-3H3