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tert-butyl 2-[4-[3-oxidanylidene-2-(2-phenoxyethanoyl)heptyl]phenyl]benzoate

tert-butyl 2-[4-[3-oxidanylidene-2-(2-phenoxyethanoyl)heptyl]phenyl]benzoate

Systemtic Name:tert-butyl 2-[4-[3-oxidanylidene-2-(2-phenoxyethanoyl)heptyl]phenyl]benzoate
Openeye Name:tert-butyl 2-[4-[3-oxo-2-(2-phenoxyacetyl)heptyl]phenyl]benzoate
CAS Name:2-[4-[3-oxo-2-(1-oxo-2-phenoxyethyl)heptyl]phenyl]benzoic acid tert-butyl ester
IUPAC Name:tert-butyl 2-[4-[3-oxo-2-(2-phenoxyacetyl)heptyl]phenyl]benzoate
Traditional Name:2-[4-[3-keto-2-(2-phenoxyacetyl)heptyl]phenyl]benzoic acid tert-butyl ester
Formula: C32H36O5
MolecularWeight: 500.62524
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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2C(=O)OC(C)(C)C)C(=O)COC3=CC=CC=C3


Isomeric SMILES

CCCCC(=O)C(CC1=CC=C(C=C1)C2=CC=CC=C2C(=O)OC(C)(C)C)C(=O)COC3=CC=CC=C3


InChI

InChI=1S/C32H36O5/c1-5-6-16-29(33)28(30(34)22-36-25-12-8-7-9-13-25)21-23-17-19-24(20-18-23)26-14-10-11-15-27(26)31(35)37-32(2,3)4/h7-15,17-20,28H,5-6,16,21-22H2,1-4H3


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