methyl 4-[butyl-[4-[[4,5-dicyano-1-(cyanomethyl)imidazol-2-yl]diazenyl]-3-methyl-phenyl]amino]butanoate

Systemtic Name: methyl 4-[butyl-[4-[[4,5-dicyano-1-(cyanomethyl)imidazol-2-yl]diazenyl]-3-methyl-phenyl]amino]butanoate Openeye Name: methyl 4-[N-butyl-4-[4,5-dicyano-1-(cyanomethyl)imidazol-2-yl]azo-3-methyl-anilino]butanoate CAS Name: 4-[N-butyl-4-[[4,5-dicyano-1-(cyanomethyl)-2-imidazolyl]azo]-3-methylanilino]butanoic acid methyl ester IUPAC Name: methyl 4-[N-butyl-4-[[4,5-dicyano-1-(cyanomethyl)imidazol-2-yl]diazenyl]-3-methylanilino]butanoate Traditional Name: 4-[N-butyl-4-[4,5-dicyano-1-(cyanomethyl)imidazol-2-yl]azo-3-methyl-anilino]butyric acid methyl ester Formula: C23H26N8O2 MolecularWeight: 446.50494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC(=O)OC)C1=CC(=C(C=C1)N=NC2=NC(=C(N2CC#N)C#N)C#N)C

Isomeric SMILES

CCCCN(CCCC(=O)OC)C1=CC(=C(C=C1)N=NC2=NC(=C(N2CC#N)C#N)C#N)C

InChI

InChI=1S/C23H26N8O2/c1-4-5-11-30(12-6-7-22(32)33-3)18-8-9-19(17(2)14-18)28-29-23-27-20(15-25)21(16-26)31(23)13-10-24/h8-9,14H,4-7,11-13H2,1-3H3