[3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxidanylidene-propyl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate

Systemtic Name: [3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxidanylidene-propyl] 2-(4-chloranyl-3-methyl-phenoxy)ethanoate Openeye Name: [3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxo-propyl] 2-(4-chloro-3-methyl-phenoxy)acetate CAS Name: 2-(4-chloro-3-methylphenoxy)acetic acid [3-cyano-3-(1,3-dimethyl-2-benzimidazolylidene)-2-oxopropyl] ester IUPAC Name: [3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-oxopropyl] 2-(4-chloro-3-methylphenoxy)acetate Traditional Name: 2-(4-chloro-3-methyl-phenoxy)acetic acid [3-cyano-3-(1,3-dimethylbenzimidazol-2-ylidene)-2-keto-propyl] ester Formula: C22H20ClN3O4 MolecularWeight: 425.8649

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC(=O)OCC(=O)C(=C2N(C3=CC=CC=C3N2C)C)C#N)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCC(=O)OCC(=O)C(=C2N(C3=CC=CC=C3N2C)C)C#N)Cl

InChI

InChI=1S/C22H20ClN3O4/c1-14-10-15(8-9-17(14)23)29-13-21(28)30-12-20(27)16(11-24)22-25(2)18-6-4-5-7-19(18)26(22)3/h4-10H,12-13H2,1-3H3