8-(oxan-2-yloxy)-7-oxidanyl-5-oxidanylidene-6-(1-phenylethyl)octanenitrile

Systemtic Name: 8-(oxan-2-yloxy)-7-oxidanyl-5-oxidanylidene-6-(1-phenylethyl)octanenitrile Openeye Name: 7-hydroxy-5-oxo-6-(1-phenylethyl)-8-tetrahydropyran-2-yloxy-octanenitrile CAS Name: 7-hydroxy-8-(2-oxanyloxy)-5-oxo-6-(1-phenylethyl)octanenitrile IUPAC Name: 7-hydroxy-8-(oxan-2-yloxy)-5-oxo-6-(1-phenylethyl)octanenitrile Traditional Name: 7-hydroxy-5-keto-6-(1-phenylethyl)-8-tetrahydropyran-2-yloxy-caprylonitrile Formula: C21H29NO4 MolecularWeight: 359.45926

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(C(COC2CCCCO2)O)C(=O)CCCC#N

Isomeric SMILES

CC(C1=CC=CC=C1)C(C(COC2CCCCO2)O)C(=O)CCCC#N

InChI

InChI=1S/C21H29NO4/c1-16(17-9-3-2-4-10-17)21(18(23)11-5-7-13-22)19(24)15-26-20-12-6-8-14-25-20/h2-4,9-10,16,19-21,24H,5-8,11-12,14-15H2,1H3