3-[2-(3H-benzimidazol-5-ylcarbonyloxy)propanoylamino]benzoic acid

Systemtic Name: 3-[2-(3H-benzimidazol-5-ylcarbonyloxy)propanoylamino]benzoic acid Openeye Name: 3-[2-(3H-benzimidazole-5-carbonyloxy)propanoylamino]benzoic acid CAS Name: 3-[[2-[3H-benzimidazol-5-yl(oxo)methoxy]-1-oxopropyl]amino]benzoic acid IUPAC Name: 3-[2-(3H-benzimidazole-5-carbonyloxy)propanoylamino]benzoic acid Traditional Name: 3-[2-(3H-benzimidazole-5-carbonyloxy)propanoylamino]benzoic acid Formula: C18H15N3O5 MolecularWeight: 353.3288

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)C(=O)O)OC(=O)C2=CC3=C(C=C2)N=CN3

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)C(=O)O)OC(=O)C2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C18H15N3O5/c1-10(16(22)21-13-4-2-3-11(7-13)17(23)24)26-18(25)12-5-6-14-15(8-12)20-9-19-14/h2-10H,1H3,(H,19,20)(H,21,22)(H,23,24)