1-[(2R)-1-(dimethylamino)-1-oxidanylidene-propan-2-yl]benzimidazole-5-carboxylate

Systemtic Name: 1-[(2R)-1-(dimethylamino)-1-oxidanylidene-propan-2-yl]benzimidazole-5-carboxylate Openeye Name: 1-[(1R)-2-(dimethylamino)-1-methyl-2-oxo-ethyl]benzimidazole-5-carboxylate CAS Name: 1-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]-5-benzimidazolecarboxylate IUPAC Name: 1-[(2R)-1-(dimethylamino)-1-oxopropan-2-yl]benzimidazole-5-carboxylate Traditional Name: 1-[(1R)-2-(dimethylamino)-2-keto-1-methyl-ethyl]benzimidazole-5-carboxylate Formula: C13H14N3O3- MolecularWeight: 260.26856

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C)N1C=NC2=C1C=CC(=C2)C(=O)[O-]

Isomeric SMILES

C[C@H](C(=O)N(C)C)N1C=NC2=C1C=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C13H15N3O3/c1-8(12(17)15(2)3)16-7-14-10-6-9(13(18)19)4-5-11(10)16/h4-8H,1-3H3,(H,18,19)/p-1/t8-/m1/s1