(6R)-6-cyano-6-(1-methylbenzimidazol-2-yl)-5-oxidanylidene-hexanoate

Systemtic Name: (6R)-6-cyano-6-(1-methylbenzimidazol-2-yl)-5-oxidanylidene-hexanoate Openeye Name: (6R)-6-cyano-6-(1-methylbenzimidazol-2-yl)-5-oxo-hexanoate CAS Name: (6R)-6-cyano-6-(1-methyl-2-benzimidazolyl)-5-oxohexanoate IUPAC Name: (6R)-6-cyano-6-(1-methylbenzimidazol-2-yl)-5-oxohexanoate Traditional Name: (6R)-6-cyano-5-keto-6-(1-methylbenzimidazol-2-yl)hexanoate Formula: C15H14N3O3- MolecularWeight: 284.28996

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(C#N)C(=O)CCCC(=O)[O-]

Isomeric SMILES

CN1C2=CC=CC=C2N=C1[C@@H](C#N)C(=O)CCCC(=O)[O-]

InChI

InChI=1S/C15H15N3O3/c1-18-12-6-3-2-5-11(12)17-15(18)10(9-16)13(19)7-4-8-14(20)21/h2-3,5-6,10H,4,7-8H2,1H3,(H,20,21)/p-1/t10-/m0/s1