(3S)-2-azanylidene-4-(4-cyanophenyl)butane-1,1,3-tricarbonitrile

Systemtic Name: (3S)-2-azanylidene-4-(4-cyanophenyl)butane-1,1,3-tricarbonitrile Openeye Name: (3S)-4-(4-cyanophenyl)-2-imino-butane-1,1,3-tricarbonitrile CAS Name: (3S)-4-(4-cyanophenyl)-2-iminobutane-1,1,3-tricarbonitrile IUPAC Name: (3S)-4-(4-cyanophenyl)-2-iminobutane-1,1,3-tricarbonitrile Traditional Name: (3S)-4-(4-cyanophenyl)-2-imino-butane-1,1,3-tricarbonitrile Formula: C14H9N5 MolecularWeight: 247.25476

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC(C#N)C(=N)C(C#N)C#N)C#N

Isomeric SMILES

C1=CC(=CC=C1C[C@H](C#N)C(=N)C(C#N)C#N)C#N

InChI

InChI=1S/C14H9N5/c15-6-11-3-1-10(2-4-11)5-12(7-16)14(19)13(8-17)9-18/h1-4,12-13,19H,5H2/t12-/m1/s1