1-[2-(diethylamino)-2-oxidanylidene-ethyl]benzimidazole-5-carboxylate

Systemtic Name: 1-[2-(diethylamino)-2-oxidanylidene-ethyl]benzimidazole-5-carboxylate Openeye Name: 1-[2-(diethylamino)-2-oxo-ethyl]benzimidazole-5-carboxylate CAS Name: 1-[2-(diethylamino)-2-oxoethyl]-5-benzimidazolecarboxylate IUPAC Name: 1-[2-(diethylamino)-2-oxoethyl]benzimidazole-5-carboxylate Traditional Name: 1-[2-(diethylamino)-2-keto-ethyl]benzimidazole-5-carboxylate Formula: C14H16N3O3- MolecularWeight: 274.29514

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN1C=NC2=C1C=CC(=C2)C(=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)CN1C=NC2=C1C=CC(=C2)C(=O)[O-]

InChI

InChI=1S/C14H17N3O3/c1-3-16(4-2)13(18)8-17-9-15-11-7-10(14(19)20)5-6-12(11)17/h5-7,9H,3-4,8H2,1-2H3,(H,19,20)/p-1