1-[(2S)-1-(diethylamino)-1-oxidanylidene-propan-2-yl]benzimidazole-5-carboxylate

Systemtic Name: 1-[(2S)-1-(diethylamino)-1-oxidanylidene-propan-2-yl]benzimidazole-5-carboxylate Openeye Name: 1-[(1S)-2-(diethylamino)-1-methyl-2-oxo-ethyl]benzimidazole-5-carboxylate CAS Name: 1-[(2S)-1-(diethylamino)-1-oxopropan-2-yl]-5-benzimidazolecarboxylate IUPAC Name: 1-[(2S)-1-(diethylamino)-1-oxopropan-2-yl]benzimidazole-5-carboxylate Traditional Name: 1-[(1S)-2-(diethylamino)-2-keto-1-methyl-ethyl]benzimidazole-5-carboxylate Formula: C15H18N3O3- MolecularWeight: 288.32172

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19N3O3/c1-4-17(5-2)14(19)10(3)18-9-16-12-8-11(15(20)21)6-7-13(12)18/h6-10H,4-5H2,1-3H3,(H,20,21)/p-1/t10-/m0/s1