[3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl] 3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate

Systemtic Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxidanylidene-propyl] 3-(3-chloranyl-4,5-dimethoxy-phenyl)prop-2-enoate Openeye Name: [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-oxo-propyl] 3-(3-chloro-4,5-dimethoxy-phenyl)prop-2-enoate CAS Name: 3-(3-chloro-4,5-dimethoxyphenyl)-2-propenoic 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-(3-chloro-4,5-dimethoxyphenyl)prop-2-enoate Traditional Name: 3-(3-chloro-4,5-dimethoxy-phenyl)acrylic acid [3-cyano-3-(1,3-dihydrobenzimidazol-2-ylidene)-2-keto-propyl] ester Formula: C22H18ClN3O5 MolecularWeight: 439.84842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=CC(=O)OCC(=O)C(=C2NC3=CC=CC=C3N2)C#N)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)C=CC(=O)OCC(=O)C(=C2NC3=CC=CC=C3N2)C#N)Cl)OC

InChI

InChI=1S/C22H18ClN3O5/c1-29-19-10-13(9-15(23)21(19)30-2)7-8-20(28)31-12-18(27)14(11-24)22-25-16-5-3-4-6-17(16)26-22/h3-10,25-26H,12H2,1-2H3