4-[[(E)-13-pyridin-2-yltridec-12-enyl]amino]benzenecarbonitrile

Systemtic Name: 4-[[(E)-13-pyridin-2-yltridec-12-enyl]amino]benzenecarbonitrile Openeye Name: 4-[[(E)-13-(2-pyridyl)tridec-12-enyl]amino]benzonitrile CAS Name: 4-[[(E)-13-(2-pyridinyl)tridec-12-enyl]amino]benzonitrile IUPAC Name: 4-[[(E)-13-pyridin-2-yltridec-12-enyl]amino]benzonitrile Traditional Name: 4-[[(E)-13-(2-pyridyl)tridec-12-enyl]amino]benzonitrile Formula: C25H33N3 MolecularWeight: 375.54962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C=CCCCCCCCCCCCNC2=CC=C(C=C2)C#N

Isomeric SMILES

C1=CC=NC(=C1)/C=C/CCCCCCCCCCCNC2=CC=C(C=C2)C#N

InChI

InChI=1S/C25H33N3/c26-22-23-16-18-25(19-17-23)28-20-12-9-7-5-3-1-2-4-6-8-10-14-24-15-11-13-21-27-24/h10-11,13-19,21,28H,1-9,12,20H2/b14-10+