[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl] 3,5-dimethylbenzoate

Systemtic Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl] 3,5-dimethylbenzoate Openeye Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxo-propyl] 3,5-dimethylbenzoate CAS Name: 3,5-dimethylbenzoic acid [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl] ester IUPAC Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxopropyl] 3,5-dimethylbenzoate Traditional Name: 3,5-dimethylbenzoic acid [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-keto-propyl] ester Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)OCC(=O)C(=C2NC3=CC=CC=C3N2)C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)OCC(=O)C(=C2NC3=CC=CC=C3N2)C#N)C

InChI

InChI=1S/C20H17N3O3/c1-12-7-13(2)9-14(8-12)20(25)26-11-18(24)15(10-21)19-22-16-5-3-4-6-17(16)23-19/h3-9,22-23H,11H2,1-2H3