4-[2-(1-adamantyl)-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile

Systemtic Name: 4-[2-(1-adamantyl)-2-oxidanylidene-ethoxy]-3-methoxy-benzenecarbonitrile Openeye Name: 4-[2-(1-adamantyl)-2-oxo-ethoxy]-3-methoxy-benzonitrile CAS Name: 4-[2-(1-adamantyl)-2-oxoethoxy]-3-methoxybenzonitrile IUPAC Name: 4-[2-(1-adamantyl)-2-oxoethoxy]-3-methoxybenzonitrile Traditional Name: 4-[2-(1-adamantyl)-2-keto-ethoxy]-3-methoxy-benzonitrile Formula: C20H23NO3 MolecularWeight: 325.40152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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