4-[2-(benzimidazol-1-yl)ethanoylamino]benzoic acid; ethanedioic acid

Systemtic Name: 4-[2-(benzimidazol-1-yl)ethanoylamino]benzoic acid; ethanedioic acid Openeye Name: 4-[[2-(benzimidazol-1-yl)acetyl]amino]benzoic acid; oxalic acid CAS Name: 4-[[2-(1-benzimidazolyl)-1-oxoethyl]amino]benzoic acid; oxalic acid IUPAC Name: 4-[[2-(benzimidazol-1-yl)acetyl]amino]benzoic acid; oxalic acid Traditional Name: 4-[[2-(benzimidazol-1-yl)acetyl]amino]benzoic acid; oxalic acid Formula: C18H15N3O7 MolecularWeight: 385.3276

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=CN2CC(=O)NC3=CC=C(C=C3)C(=O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)N=CN2CC(=O)NC3=CC=C(C=C3)C(=O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H13N3O3.C2H2O4/c20-15(18-12-7-5-11(6-8-12)16(21)22)9-19-10-17-13-3-1-2-4-14(13)19;3-1(4)2(5)6/h1-8,10H,9H2,(H,18,20)(H,21,22);(H,3,4)(H,5,6)