2-[3-(4-cyclopentylcarbonylphenyl)prop-2-ynylamino]benzenecarbonitrile

Systemtic Name: 2-[3-(4-cyclopentylcarbonylphenyl)prop-2-ynylamino]benzenecarbonitrile Openeye Name: 2-[3-[4-(cyclopentanecarbonyl)phenyl]prop-2-ynylamino]benzonitrile CAS Name: 2-[3-[4-[cyclopentyl(oxo)methyl]phenyl]prop-2-ynylamino]benzonitrile IUPAC Name: 2-[3-[4-(cyclopentanecarbonyl)phenyl]prop-2-ynylamino]benzonitrile Traditional Name: 2-[3-[4-(cyclopentanecarbonyl)phenyl]prop-2-ynylamino]benzonitrile Formula: C22H20N2O MolecularWeight: 328.407

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)C2=CC=C(C=C2)C#CCNC3=CC=CC=C3C#N

Isomeric SMILES

C1CCC(C1)C(=O)C2=CC=C(C=C2)C#CCNC3=CC=CC=C3C#N

InChI

InChI=1S/C22H20N2O/c23-16-20-9-3-4-10-21(20)24-15-5-6-17-11-13-19(14-12-17)22(25)18-7-1-2-8-18/h3-4,9-14,18,24H,1-2,7-8,15H2