2-[3-(1-adamantyl)-4-methoxy-phenyl]ethanoate

Systemtic Name: 2-[3-(1-adamantyl)-4-methoxy-phenyl]ethanoate Openeye Name: 2-[3-(1-adamantyl)-4-methoxy-phenyl]acetate CAS Name: 2-[3-(1-adamantyl)-4-methoxyphenyl]acetate IUPAC Name: 2-[3-(1-adamantyl)-4-methoxyphenyl]acetate Traditional Name: 2-[3-(1-adamantyl)-4-methoxy-phenyl]acetate Formula: C19H23O3- MolecularWeight: 299.38412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H24O3/c1-22-17-3-2-12(8-18(20)21)7-16(17)19-9-13-4-14(10-19)6-15(5-13)11-19/h2-3,7,13-15H,4-6,8-11H2,1H3,(H,20,21)/p-1