2-[4-(5,7-ditert-butyl-2-oxidanylidene-3H-1-benzofuran-3-yl)phenoxy]ethyl octadecanoate

Systemtic Name: 2-[4-(5,7-ditert-butyl-2-oxidanylidene-3H-1-benzofuran-3-yl)phenoxy]ethyl octadecanoate Openeye Name: 2-[4-(5,7-ditert-butyl-2-oxo-3H-benzofuran-3-yl)phenoxy]ethyl octadecanoate CAS Name: octadecanoic acid 2-[4-(5,7-ditert-butyl-2-oxo-3H-benzofuran-3-yl)phenoxy]ethyl ester IUPAC Name: 2-[4-(5,7-ditert-butyl-2-oxo-3H-1-benzofuran-3-yl)phenoxy]ethyl octadecanoate Traditional Name: stearic acid 2-[4-(5,7-ditert-butyl-2-keto-coumaran-3-yl)phenoxy]ethyl ester Formula: C42H64O5 MolecularWeight: 648.95456

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)OCCOC1=CC=C(C=C1)C2C3=CC(=CC(=C3OC2=O)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)OCCOC1=CC=C(C=C1)C2C3=CC(=CC(=C3OC2=O)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C42H64O5/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-37(43)46-29-28-45-34-26-24-32(25-27-34)38-35-30-33(41(2,3)4)31-36(42(5,6)7)39(35)47-40(38)44/h24-27,30-31,38H,8-23,28-29H2,1-7H3