cyanomethyl 3-(4-methoxyphenyl)adamantane-1-carboxylate

Systemtic Name: cyanomethyl 3-(4-methoxyphenyl)adamantane-1-carboxylate Openeye Name: cyanomethyl 3-(4-methoxyphenyl)adamantane-1-carboxylate CAS Name: 3-(4-methoxyphenyl)-1-adamantanecarboxylic acid cyanomethyl ester IUPAC Name: cyanomethyl 3-(4-methoxyphenyl)adamantane-1-carboxylate Traditional Name: 3-(4-methoxyphenyl)adamantane-1-carboxylic acid cyanomethyl ester Formula: C20H23NO3 MolecularWeight: 325.40152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23NO3/c1-23-17-4-2-16(3-5-17)19-9-14-8-15(10-19)12-20(11-14,13-19)18(22)24-7-6-21/h2-5,14-15H,7-13H2,1H3