2-[(1-dodecylazepan-2-ylidene)amino]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[(1-dodecylazepan-2-ylidene)amino]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[(1-dodecylazepan-2-ylidene)amino]-6-fluoro-benzonitrile CAS Name: 2-[(1-dodecyl-2-azepanylidene)amino]-6-fluorobenzonitrile IUPAC Name: 2-[(1-dodecylazepan-2-ylidene)amino]-6-fluorobenzonitrile Traditional Name: 2-fluoro-6-[(1-laurylazepan-2-ylidene)amino]benzonitrile Formula: C25H38FN3 MolecularWeight: 399.587723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1CCCCCC1=NC2=C(C(=CC=C2)F)C#N

Isomeric SMILES

CCCCCCCCCCCCN1CCCCCC1=NC2=C(C(=CC=C2)F)C#N

InChI

InChI=1S/C25H38FN3/c1-2-3-4-5-6-7-8-9-10-13-19-29-20-14-11-12-18-25(29)28-24-17-15-16-23(26)22(24)21-27/h15-17H,2-14,18-20H2,1H3