2-[(2S)-octan-2-yl]oxybenzenecarbonitrile

Systemtic Name: 2-[(2S)-octan-2-yl]oxybenzenecarbonitrile Openeye Name: 2-[(1S)-1-methylheptoxy]benzonitrile CAS Name: 2-[(2S)-octan-2-yl]oxybenzonitrile IUPAC Name: 2-[(2S)-octan-2-yl]oxybenzonitrile Traditional Name: 2-[(1S)-1-methylheptoxy]benzonitrile Formula: C15H21NO MolecularWeight: 231.33334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC1=CC=CC=C1C#N

Isomeric SMILES

CCCCCC[C@H](C)OC1=CC=CC=C1C#N

InChI

InChI=1S/C15H21NO/c1-3-4-5-6-9-13(2)17-15-11-8-7-10-14(15)12-16/h7-8,10-11,13H,3-6,9H2,1-2H3/t13-/m0/s1