[2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-(3-methoxyphenyl)ethanoate

Systemtic Name: [2-(1-adamantyl)-2-oxidanylidene-ethyl] 2-(3-methoxyphenyl)ethanoate Openeye Name: [2-(1-adamantyl)-2-oxo-ethyl] 2-(3-methoxyphenyl)acetate CAS Name: 2-(3-methoxyphenyl)acetic acid [2-(1-adamantyl)-2-oxoethyl] ester IUPAC Name: [2-(1-adamantyl)-2-oxoethyl] 2-(3-methoxyphenyl)acetate Traditional Name: 2-(3-methoxyphenyl)acetic acid [2-(1-adamantyl)-2-keto-ethyl] ester Formula: C21H26O4 MolecularWeight: 342.42874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC(=O)OCC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

COC1=CC=CC(=C1)CC(=O)OCC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C21H26O4/c1-24-18-4-2-3-14(8-18)9-20(23)25-13-19(22)21-10-15-5-16(11-21)7-17(6-15)12-21/h2-4,8,15-17H,5-7,9-13H2,1H3