3-(2-ethylhexoxymethyl)benzenecarbonitrile

Systemtic Name: 3-(2-ethylhexoxymethyl)benzenecarbonitrile Openeye Name: 3-(2-ethylhexoxymethyl)benzonitrile CAS Name: 3-(2-ethylhexoxymethyl)benzonitrile IUPAC Name: 3-(2-ethylhexoxymethyl)benzonitrile Traditional Name: 3-(2-ethylhexoxymethyl)benzonitrile Formula: C16H23NO MolecularWeight: 245.35992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COCC1=CC=CC(=C1)C#N

Isomeric SMILES

CCCCC(CC)COCC1=CC=CC(=C1)C#N

InChI

InChI=1S/C16H23NO/c1-3-5-7-14(4-2)12-18-13-16-9-6-8-15(10-16)11-17/h6,8-10,14H,3-5,7,12-13H2,1-2H3