[3-[2-adamantylidene(2-iodanylethoxy)methyl]phenyl] ethanoate

Systemtic Name: [3-[2-adamantylidene(2-iodanylethoxy)methyl]phenyl] ethanoate Openeye Name: [3-[2-adamantylidene(2-iodoethoxy)methyl]phenyl] acetate CAS Name: acetic acid [3-[2-adamantylidene(2-iodoethoxy)methyl]phenyl] ester IUPAC Name: [3-[2-adamantylidene(2-iodoethoxy)methyl]phenyl] acetate Traditional Name: acetic acid [3-[2-adamantylidene(2-iodoethoxy)methyl]phenyl] ester Formula: C21H25IO3 MolecularWeight: 452.32587

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1=CC=CC(=C1)C(=C2C3CC4CC(C3)CC2C4)OCCI

Isomeric SMILES

CC(=O)OC1=CC=CC(=C1)C(=C2C3CC4CC(C3)CC2C4)OCCI

InChI

InChI=1S/C21H25IO3/c1-13(23)25-19-4-2-3-16(12-19)21(24-6-5-22)20-17-8-14-7-15(10-17)11-18(20)9-14/h2-4,12,14-15,17-18H,5-11H2,1H3