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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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