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

Systemtic Name: 1-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]benzimidazole-5-carboxylate Openeye Name: 1-[2-(isopropylamino)-2-oxo-ethyl]benzimidazole-5-carboxylate CAS Name: 1-[2-oxo-2-(propan-2-ylamino)ethyl]-5-benzimidazolecarboxylate IUPAC Name: 1-[2-oxo-2-(propan-2-ylamino)ethyl]benzimidazole-5-carboxylate Traditional Name: 1-[2-(isopropylamino)-2-keto-ethyl]benzimidazole-5-carboxylate Formula: C13H14N3O3- MolecularWeight: 260.26856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O3/c1-8(2)15-12(17)6-16-7-14-10-5-9(13(18)19)3-4-11(10)16/h3-5,7-8H,6H2,1-2H3,(H,15,17)(H,18,19)/p-1