3-(1-adamantyl)-4-(2-methoxy-2-oxidanylidene-ethoxy)benzoate

Systemtic Name: 3-(1-adamantyl)-4-(2-methoxy-2-oxidanylidene-ethoxy)benzoate Openeye Name: 3-(1-adamantyl)-4-(2-methoxy-2-oxo-ethoxy)benzoate CAS Name: 3-(1-adamantyl)-4-(2-methoxy-2-oxoethoxy)benzoate IUPAC Name: 3-(1-adamantyl)-4-(2-methoxy-2-oxoethoxy)benzoate Traditional Name: 3-(1-adamantyl)-4-(2-keto-2-methoxy-ethoxy)benzoate Formula: C20H23O5- MolecularWeight: 343.39362

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)COC1=C(C=C(C=C1)C(=O)[O-])C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC(=O)COC1=C(C=C(C=C1)C(=O)[O-])C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H24O5/c1-24-18(21)11-25-17-3-2-15(19(22)23)7-16(17)20-8-12-4-13(9-20)6-14(5-12)10-20/h2-3,7,12-14H,4-6,8-11H2,1H3,(H,22,23)/p-1