(3S)-2-azanyl-4-(3-chlorophenyl)but-1-ene-1,1,3-tricarbonitrile

Systemtic Name: (3S)-2-azanyl-4-(3-chlorophenyl)but-1-ene-1,1,3-tricarbonitrile Openeye Name: (3S)-2-amino-4-(3-chlorophenyl)but-1-ene-1,1,3-tricarbonitrile CAS Name: (3S)-2-amino-4-(3-chlorophenyl)-1-butene-1,1,3-tricarbonitrile IUPAC Name: (3S)-2-amino-4-(3-chlorophenyl)but-1-ene-1,1,3-tricarbonitrile Traditional Name: (3S)-2-amino-4-(3-chlorophenyl)but-1-ene-1,1,3-tricarbonitrile Formula: C13H9ClN4 MolecularWeight: 256.69036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H9ClN4/c14-12-3-1-2-9(5-12)4-10(6-15)13(18)11(7-16)8-17/h1-3,5,10H,4,18H2/t10-/m1/s1