ethyl 2-[(E)-2-anthracen-9-yl-1-cyano-ethenyl]benzimidazole-1-carboxylate

Systemtic Name: ethyl 2-[(E)-2-anthracen-9-yl-1-cyano-ethenyl]benzimidazole-1-carboxylate Openeye Name: ethyl 2-[(E)-2-(9-anthryl)-1-cyano-vinyl]benzimidazole-1-carboxylate CAS Name: 2-[(E)-2-(9-anthracenyl)-1-cyanoethenyl]-1-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(E)-2-anthracen-9-yl-1-cyanoethenyl]benzimidazole-1-carboxylate Traditional Name: 2-[(E)-2-(9-anthryl)-1-cyano-vinyl]benzimidazole-1-carboxylic acid ethyl ester Formula: C27H19N3O2 MolecularWeight: 417.45866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=CC=CC=C2N=C1C(=CC3=C4C=CC=CC4=CC5=CC=CC=C53)C#N

Isomeric SMILES

CCOC(=O)N1C2=CC=CC=C2N=C1/C(=C/C3=C4C=CC=CC4=CC5=CC=CC=C53)/C#N

InChI

InChI=1S/C27H19N3O2/c1-2-32-27(31)30-25-14-8-7-13-24(25)29-26(30)20(17-28)16-23-21-11-5-3-9-18(21)15-19-10-4-6-12-22(19)23/h3-16H,2H2,1H3/b20-16+