2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-3-(3,4,5-triethoxyphenyl)propanenitrile

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxidanylidene-3-(3,4,5-triethoxyphenyl)propanenitrile Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-3-(3,4,5-triethoxyphenyl)propanenitrile CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-3-(3,4,5-triethoxyphenyl)propanenitrile IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-oxo-3-(3,4,5-triethoxyphenyl)propanenitrile Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-3-keto-3-(3,4,5-triethoxyphenyl)propionitrile Formula: C22H23N3O4 MolecularWeight: 393.43572

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)C(=C2NC3=CC=CC=C3N2)C#N

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)C(=C2NC3=CC=CC=C3N2)C#N

InChI

InChI=1S/C22H23N3O4/c1-4-27-18-11-14(12-19(28-5-2)21(18)29-6-3)20(26)15(13-23)22-24-16-9-7-8-10-17(16)25-22/h7-12,24-25H,4-6H2,1-3H3