5-oxidanylidene-9-phenylmethoxy-nonanenitrile

Systemtic Name: 5-oxidanylidene-9-phenylmethoxy-nonanenitrile Openeye Name: 9-benzyloxy-5-oxo-nonanenitrile CAS Name: 5-oxo-9-phenylmethoxynonanenitrile IUPAC Name: 5-oxo-9-phenylmethoxynonanenitrile Traditional Name: 9-benzoxy-5-keto-pelargononitrile Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO2/c17-12-6-4-10-16(18)11-5-7-13-19-14-15-8-2-1-3-9-15/h1-3,8-9H,4-7,10-11,13-14H2