2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-4-(4-propylphenoxy)butanenitrile

Systemtic Name: 2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-4-(4-propylphenoxy)butanenitrile Openeye Name: 2-(1-methylbenzimidazol-2-yl)-3-oxo-4-(4-propylphenoxy)butanenitrile CAS Name: 2-(1-methyl-2-benzimidazolyl)-3-oxo-4-(4-propylphenoxy)butanenitrile IUPAC Name: 2-(1-methylbenzimidazol-2-yl)-3-oxo-4-(4-propylphenoxy)butanenitrile Traditional Name: 3-keto-2-(1-methylbenzimidazol-2-yl)-4-(4-propylphenoxy)butyronitrile Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)OCC(=O)C(C#N)C2=NC3=CC=CC=C3N2C

Isomeric SMILES

CCCC1=CC=C(C=C1)OCC(=O)C(C#N)C2=NC3=CC=CC=C3N2C

InChI

InChI=1S/C21H21N3O2/c1-3-6-15-9-11-16(12-10-15)26-14-20(25)17(13-22)21-23-18-7-4-5-8-19(18)24(21)2/h4-5,7-12,17H,3,6,14H2,1-2H3