ethanedioic acid; methyl 4-[2-[(phenylmethyl)amino]ethanoylamino]benzoate

Systemtic Name: ethanedioic acid; methyl 4-[2-[(phenylmethyl)amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-(benzylamino)acetyl]amino]benzoate; oxalic acid CAS Name: oxalic acid; 4-[[1-oxo-2-[(phenylmethyl)amino]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(benzylamino)acetyl]amino]benzoate; oxalic acid Traditional Name: 4-[[2-(benzylamino)acetyl]amino]benzoic acid methyl ester; oxalic acid Formula: C19H20N2O7 MolecularWeight: 388.3713

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)CNCC2=CC=CC=C2.C(=O)(C(=O)O)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)CNCC2=CC=CC=C2.C(=O)(C(=O)O)O

InChI

InChI=1S/C17H18N2O3.C2H2O4/c1-22-17(21)14-7-9-15(10-8-14)19-16(20)12-18-11-13-5-3-2-4-6-13;3-1(4)2(5)6/h2-10,18H,11-12H2,1H3,(H,19,20);(H,3,4)(H,5,6)