butyl 2-[3-(benzimidazol-2-ylideneamino)-2H-isoindol-1-yl]-2-cyano-ethanoate

Systemtic Name: butyl 2-[3-(benzimidazol-2-ylideneamino)-2H-isoindol-1-yl]-2-cyano-ethanoate Openeye Name: butyl 2-[3-(benzimidazol-2-ylideneamino)-2H-isoindol-1-yl]-2-cyano-acetate CAS Name: 2-[3-(2-benzimidazolylideneamino)-2H-isoindol-1-yl]-2-cyanoacetic acid butyl ester IUPAC Name: butyl 2-[3-(benzimidazol-2-ylideneamino)-2H-isoindol-1-yl]-2-cyanoacetate Traditional Name: 2-[3-(benzimidazol-2-ylideneamino)-2H-isoindol-1-yl]-2-cyano-acetic acid butyl ester Formula: C22H19N5O2 MolecularWeight: 385.41856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C(C#N)C1=C2C=CC=CC2=C(N1)N=C3N=C4C=CC=CC4=N3

Isomeric SMILES

CCCCOC(=O)C(C#N)C1=C2C=CC=CC2=C(N1)N=C3N=C4C=CC=CC4=N3

InChI

InChI=1S/C22H19N5O2/c1-2-3-12-29-21(28)16(13-23)19-14-8-4-5-9-15(14)20(26-19)27-22-24-17-10-6-7-11-18(17)25-22/h4-11,16,26H,2-3,12H2,1H3