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4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzenecarbonitrile

4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzenecarbonitrile

Systemtic Name:4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzenecarbonitrile
Openeye Name:4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzonitrile
CAS Name:4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzonitrile
IUPAC Name:4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzonitrile
Traditional Name:4-[18-(4-chlorophenyl)octadec-17-ynylamino]benzonitrile
Formula: C31H41ClN2
MolecularWeight: 477.12364
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#CCCCCCCCCCCCCCCCCNC2=CC=C(C=C2)C#N)Cl


Isomeric SMILES

C1=CC(=CC=C1C#CCCCCCCCCCCCCCCCCNC2=CC=C(C=C2)C#N)Cl


InChI

InChI=1S/C31H41ClN2/c32-30-22-18-28(19-23-30)17-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16-26-34-31-24-20-29(27-33)21-25-31/h18-25,34H,1-14,16,26H2


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