2-(1-methylbenzimidazol-2-yl)-3-oxidanylidene-4-(2-propan-2-ylphenoxy)butanenitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1OCC(=O)C(C#N)C2=NC3=CC=CC=C3N2C

Isomeric SMILES

CC(C)C1=CC=CC=C1OCC(=O)C(C#N)C2=NC3=CC=CC=C3N2C

InChI

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