3-[[(E)-octadec-9-enyl]amino]benzenecarbonitrile

Systemtic Name: 3-[[(E)-octadec-9-enyl]amino]benzenecarbonitrile Openeye Name: 3-[[(E)-octadec-9-enyl]amino]benzonitrile CAS Name: 3-[[(E)-octadec-9-enyl]amino]benzonitrile IUPAC Name: 3-[[(E)-octadec-9-enyl]amino]benzonitrile Traditional Name: 3-[[(E)-octadec-9-enyl]amino]benzonitrile Formula: C25H40N2 MolecularWeight: 368.5985

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCNC1=CC=CC(=C1)C#N

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCCNC1=CC=CC(=C1)C#N

InChI

InChI=1S/C25H40N2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-21-27-25-20-18-19-24(22-25)23-26/h9-10,18-20,22,27H,2-8,11-17,21H2,1H3/b10-9+