4-[(3S)-3-fluoranylnonyl]benzenecarbonitrile

Systemtic Name: 4-[(3S)-3-fluoranylnonyl]benzenecarbonitrile Openeye Name: 4-[(3S)-3-fluorononyl]benzonitrile CAS Name: 4-[(3S)-3-fluorononyl]benzonitrile IUPAC Name: 4-[(3S)-3-fluorononyl]benzonitrile Traditional Name: 4-[(3S)-3-fluorononyl]benzonitrile Formula: C16H22FN MolecularWeight: 247.350983

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CCC1=CC=C(C=C1)C#N)F

Isomeric SMILES

CCCCCC[C@@H](CCC1=CC=C(C=C1)C#N)F

InChI

InChI=1S/C16H22FN/c1-2-3-4-5-6-16(17)12-11-14-7-9-15(13-18)10-8-14/h7-10,16H,2-6,11-12H2,1H3/t16-/m0/s1