(2-chloranyl-5-nitro-phenyl)methyl-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl]-methyl-azanium

Systemtic Name: (2-chloranyl-5-nitro-phenyl)methyl-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl]-methyl-azanium Openeye Name: (2-chloro-5-nitro-phenyl)methyl-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxo-propyl]-methyl-ammonium CAS Name: (2-chloro-5-nitrophenyl)methyl-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl]-methylammonium IUPAC Name: (2-chloro-5-nitrophenyl)methyl-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl]-methylazanium Traditional Name: (2-chloro-5-nitro-benzyl)-[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-keto-propyl]-methyl-ammonium Formula: C19H17ClN5O3+ MolecularWeight: 398.82298

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)C(=C2NC3=CC=CC=C3N2)C#N

Isomeric SMILES

C[NH+](CC1=C(C=CC(=C1)[N+](=O)[O-])Cl)CC(=O)C(=C2NC3=CC=CC=C3N2)C#N

InChI

InChI=1S/C19H16ClN5O3/c1-24(10-12-8-13(25(27)28)6-7-15(12)20)11-18(26)14(9-21)19-22-16-4-2-3-5-17(16)23-19/h2-8,22-23H,10-11H2,1H3/p+1