(2S,4R,5R)-3-azanylidene-4-chloranyl-5-methyl-4-nitro-cyclopentane-1,1,2-tricarbonitrile

Systemtic Name: (2S,4R,5R)-3-azanylidene-4-chloranyl-5-methyl-4-nitro-cyclopentane-1,1,2-tricarbonitrile Openeye Name: (2S,4R,5R)-4-chloro-3-imino-5-methyl-4-nitro-cyclopentane-1,1,2-tricarbonitrile CAS Name: (2S,4R,5R)-4-chloro-3-imino-5-methyl-4-nitrocyclopentane-1,1,2-tricarbonitrile IUPAC Name: (2S,4R,5R)-4-chloro-3-imino-5-methyl-4-nitrocyclopentane-1,1,2-tricarbonitrile Traditional Name: (2S,4R,5R)-4-chloro-3-imino-5-methyl-4-nitro-cyclopentane-1,1,2-tricarbonitrile Formula: C9H6ClN5O2 MolecularWeight: 251.62924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(C(C(=N)C1([N+](=O)[O-])Cl)C#N)(C#N)C#N

Isomeric SMILES

C[C@H]1[C@@](C(=N)[C@H](C1(C#N)C#N)C#N)([N+](=O)[O-])Cl

InChI

InChI=1S/C9H6ClN5O2/c1-5-8(3-12,4-13)6(2-11)7(14)9(5,10)15(16)17/h5-6,14H,1H3/t5-,6-,9+/m1/s1