dimethyl 3-cyano-3-(1-methylbenzimidazol-2-yl)pentanedioate

Systemtic Name: dimethyl 3-cyano-3-(1-methylbenzimidazol-2-yl)pentanedioate Openeye Name: dimethyl 3-cyano-3-(1-methylbenzimidazol-2-yl)pentanedioate CAS Name: 3-cyano-3-(1-methyl-2-benzimidazolyl)pentanedioic acid dimethyl ester IUPAC Name: dimethyl 3-cyano-3-(1-methylbenzimidazol-2-yl)pentanedioate Traditional Name: 3-cyano-3-(1-methylbenzimidazol-2-yl)glutaric acid dimethyl ester Formula: C16H17N3O4 MolecularWeight: 315.32388

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(CC(=O)OC)(CC(=O)OC)C#N

Isomeric SMILES

CN1C2=CC=CC=C2N=C1C(CC(=O)OC)(CC(=O)OC)C#N

InChI

InChI=1S/C16H17N3O4/c1-19-12-7-5-4-6-11(12)18-15(19)16(10-17,8-13(20)22-2)9-14(21)23-3/h4-7H,8-9H2,1-3H3