[(2R)-4-cyano-4-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-butan-2-yl]-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: [(2R)-4-cyano-4-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-butan-2-yl]-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: [(1R)-3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-1-methyl-2-oxo-propyl]-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [(2R)-4-cyano-4-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxobutan-2-yl]-[2-(2,6-dimethylanilino)-2-oxoethyl]-methylammonium IUPAC Name: [(2R)-4-cyano-4-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxobutan-2-yl]-[2-(2,6-dimethylanilino)-2-oxoethyl]-methylazanium Traditional Name: [(1R)-3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-keto-1-methyl-propyl]-[2-(2,6-dimethylanilino)-2-keto-ethyl]-methyl-ammonium Formula: C23H26N5O2+ MolecularWeight: 404.48484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+](C)[C@H](C)C(=O)C(=C2NC3=CC=CC=C3N2)C#N

InChI

InChI=1S/C23H25N5O2/c1-14-8-7-9-15(2)21(14)27-20(29)13-28(4)16(3)22(30)17(12-24)23-25-18-10-5-6-11-19(18)26-23/h5-11,16,25-26H,13H2,1-4H3,(H,27,29)/p+1/t16-/m1/s1