4-cyano-3-methyl-2-[(2-methyl-4-nitro-5-pyrrolidin-1-yl-phenyl)iminomethyl]pyrido[1,2-a]benzimidazol-1-olate

Systemtic Name: 4-cyano-3-methyl-2-[(2-methyl-4-nitro-5-pyrrolidin-1-yl-phenyl)iminomethyl]pyrido[1,2-a]benzimidazol-1-olate Openeye Name: 4-cyano-3-methyl-2-[(2-methyl-4-nitro-5-pyrrolidin-1-yl-phenyl)iminomethyl]pyrido[1,2-a]benzimidazol-1-olate CAS Name: 4-cyano-3-methyl-2-[[2-methyl-4-nitro-5-(1-pyrrolidinyl)phenyl]iminomethyl]-1-pyrido[1,2-a]benzimidazololate IUPAC Name: 4-cyano-3-methyl-2-[(2-methyl-4-nitro-5-pyrrolidin-1-ylphenyl)iminomethyl]pyrido[1,2-a]benzimidazol-1-olate Traditional Name: 4-cyano-3-methyl-2-[(2-methyl-4-nitro-5-pyrrolidino-phenyl)iminomethyl]pyrido[1,2-a]benzimidazol-1-olate Formula: C25H21N6O3- MolecularWeight: 453.47264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1N=CC2=C(N3C4=CC=CC=C4N=C3C(=C2C)C#N)[O-])N5CCCC5)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1N=CC2=C(N3C4=CC=CC=C4N=C3C(=C2C)C#N)[O-])N5CCCC5)[N+](=O)[O-]

InChI

InChI=1S/C25H22N6O3/c1-15-11-23(31(33)34)22(29-9-5-6-10-29)12-20(15)27-14-18-16(2)17(13-26)24-28-19-7-3-4-8-21(19)30(24)25(18)32/h3-4,7-8,11-12,14,32H,5-6,9-10H2,1-2H3/p-1