ethyl (3E)-3-[2-[(4-cyanophenyl)methyl]-1-methyl-6H-benzimidazol-5-ylidene]-4-oxidanylidene-4-pyrrolidin-1-yl-butanoate

Systemtic Name: ethyl (3E)-3-[2-[(4-cyanophenyl)methyl]-1-methyl-6H-benzimidazol-5-ylidene]-4-oxidanylidene-4-pyrrolidin-1-yl-butanoate Openeye Name: ethyl (3E)-3-[2-[(4-cyanophenyl)methyl]-1-methyl-6H-benzimidazol-5-ylidene]-4-oxo-4-pyrrolidin-1-yl-butanoate CAS Name: (3E)-3-[2-[(4-cyanophenyl)methyl]-1-methyl-6H-benzimidazol-5-ylidene]-4-oxo-4-(1-pyrrolidinyl)butanoic acid ethyl ester IUPAC Name: ethyl (3E)-3-[2-[(4-cyanophenyl)methyl]-1-methyl-6H-benzimidazol-5-ylidene]-4-oxo-4-pyrrolidin-1-ylbutanoate Traditional Name: (3E)-3-[2-(4-cyanobenzyl)-1-methyl-6H-benzimidazol-5-ylidene]-4-keto-4-pyrrolidino-butyric acid ethyl ester Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=C1CC=C2C(=C1)N=C(N2C)CC3=CC=C(C=C3)C#N)C(=O)N4CCCC4

Isomeric SMILES

CCOC(=O)C/C(=C\1/CC=C2C(=C1)N=C(N2C)CC3=CC=C(C=C3)C#N)/C(=O)N4CCCC4

InChI

InChI=1S/C26H28N4O3/c1-3-33-25(31)16-21(26(32)30-12-4-5-13-30)20-10-11-23-22(15-20)28-24(29(23)2)14-18-6-8-19(17-27)9-7-18/h6-9,11,15H,3-5,10,12-14,16H2,1-2H3/b21-20+