2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxidanylidene-3-(4-pentoxyphenyl)propanenitrile

Systemtic Name: 2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxidanylidene-3-(4-pentoxyphenyl)propanenitrile Openeye Name: 2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxo-3-(4-pentoxyphenyl)propanenitrile CAS Name: 2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxo-3-(4-pentoxyphenyl)propanenitrile IUPAC Name: 2-(3-methyl-1H-benzimidazol-2-ylidene)-3-oxo-3-(4-pentoxyphenyl)propanenitrile Traditional Name: 3-(4-amoxyphenyl)-3-keto-2-(3-methyl-1H-benzimidazol-2-ylidene)propionitrile Formula: C22H23N3O2 MolecularWeight: 361.43692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)C(=C2NC3=CC=CC=C3N2C)C#N

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)C(=C2NC3=CC=CC=C3N2C)C#N

InChI

InChI=1S/C22H23N3O2/c1-3-4-7-14-27-17-12-10-16(11-13-17)21(26)18(15-23)22-24-19-8-5-6-9-20(19)25(22)2/h5-6,8-13,24H,3-4,7,14H2,1-2H3