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heptyl 4-(5,7-ditert-butyl-2-oxidanylidene-3H-1-benzofuran-3-yl)benzoate

heptyl 4-(5,7-ditert-butyl-2-oxidanylidene-3H-1-benzofuran-3-yl)benzoate

Systemtic Name:heptyl 4-(5,7-ditert-butyl-2-oxidanylidene-3H-1-benzofuran-3-yl)benzoate
Openeye Name:heptyl 4-(5,7-ditert-butyl-2-oxo-3H-benzofuran-3-yl)benzoate
CAS Name:4-(5,7-ditert-butyl-2-oxo-3H-benzofuran-3-yl)benzoic acid heptyl ester
IUPAC Name:heptyl 4-(5,7-ditert-butyl-2-oxo-3H-1-benzofuran-3-yl)benzoate
Traditional Name:4-(5,7-ditert-butyl-2-keto-coumaran-3-yl)benzoic acid heptyl ester
Formula: C30H40O4
MolecularWeight: 464.6362
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=CC=C(C=C1)C2C3=CC(=CC(=C3OC2=O)C(C)(C)C)C(C)(C)C


Isomeric SMILES

CCCCCCCOC(=O)C1=CC=C(C=C1)C2C3=CC(=CC(=C3OC2=O)C(C)(C)C)C(C)(C)C


InChI

InChI=1S/C30H40O4/c1-8-9-10-11-12-17-33-27(31)21-15-13-20(14-16-21)25-23-18-22(29(2,3)4)19-24(30(5,6)7)26(23)34-28(25)32/h13-16,18-19,25H,8-12,17H2,1-7H3


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