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4-[5-(1-adamantyl)-2,4-dimethoxy-phenyl]carbonyloxybenzoic acid

4-[5-(1-adamantyl)-2,4-dimethoxy-phenyl]carbonyloxybenzoic acid

Systemtic Name:4-[5-(1-adamantyl)-2,4-dimethoxy-phenyl]carbonyloxybenzoic acid
Openeye Name:4-[5-(1-adamantyl)-2,4-dimethoxy-benzoyl]oxybenzoic acid
CAS Name:4-[[5-(1-adamantyl)-2,4-dimethoxyphenyl]-oxomethoxy]benzoic acid
IUPAC Name:4-[5-(1-adamantyl)-2,4-dimethoxybenzoyl]oxybenzoic acid
Traditional Name:4-[5-(1-adamantyl)-2,4-dimethoxy-benzoyl]oxybenzoic acid
Formula: C26H28O6
MolecularWeight: 436.49692
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1C(=O)OC2=CC=C(C=C2)C(=O)O)C34CC5CC(C3)CC(C5)C4)OC


Isomeric SMILES

COC1=CC(=C(C=C1C(=O)OC2=CC=C(C=C2)C(=O)O)C34CC5CC(C3)CC(C5)C4)OC


InChI

InChI=1S/C26H28O6/c1-30-22-11-23(31-2)21(26-12-15-7-16(13-26)9-17(8-15)14-26)10-20(22)25(29)32-19-5-3-18(4-6-19)24(27)28/h3-6,10-11,15-17H,7-9,12-14H2,1-2H3,(H,27,28)


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