1-[(2S)-1-methoxypropan-2-yl]-2-oxidanylidene-3H-benzimidazole-5-carboxylate

Systemtic Name: 1-[(2S)-1-methoxypropan-2-yl]-2-oxidanylidene-3H-benzimidazole-5-carboxylate Openeye Name: 1-[(1S)-2-methoxy-1-methyl-ethyl]-2-oxo-3H-benzimidazole-5-carboxylate CAS Name: 1-[(2S)-1-methoxypropan-2-yl]-2-oxo-3H-benzimidazole-5-carboxylate IUPAC Name: 1-[(2S)-1-methoxypropan-2-yl]-2-oxo-3H-benzimidazole-5-carboxylate Traditional Name: 2-keto-1-[(1S)-2-methoxy-1-methyl-ethyl]-3H-benzimidazole-5-carboxylate Formula: C12H13N2O4- MolecularWeight: 249.24262

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)N1C2=C(C=C(C=C2)C(=O)[O-])NC1=O

Isomeric SMILES

C[C@@H](COC)N1C2=C(C=C(C=C2)C(=O)[O-])NC1=O

InChI

InChI=1S/C12H14N2O4/c1-7(6-18-2)14-10-4-3-8(11(15)16)5-9(10)13-12(14)17/h3-5,7H,6H2,1-2H3,(H,13,17)(H,15,16)/p-1/t7-/m0/s1