ethanedioic acid; ethyl 2-[2-[(2-chlorophenyl)methyl-methyl-amino]ethanoylamino]benzoate

Systemtic Name: ethanedioic acid; ethyl 2-[2-[(2-chlorophenyl)methyl-methyl-amino]ethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[(2-chlorophenyl)methyl-methyl-amino]acetyl]amino]benzoate; oxalic acid CAS Name: 2-[[2-[(2-chlorophenyl)methyl-methylamino]-1-oxoethyl]amino]benzoic acid ethyl ester; oxalic acid IUPAC Name: ethyl 2-[[2-[(2-chlorophenyl)methyl-methylamino]acetyl]amino]benzoate; oxalic acid Traditional Name: 2-[[2-[(2-chlorobenzyl)-methyl-amino]acetyl]amino]benzoic acid ethyl ester; oxalic acid Formula: C21H23ClN2O7 MolecularWeight: 450.86952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)CN(C)CC2=CC=CC=C2Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)CN(C)CC2=CC=CC=C2Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H21ClN2O3.C2H2O4/c1-3-25-19(24)15-9-5-7-11-17(15)21-18(23)13-22(2)12-14-8-4-6-10-16(14)20;3-1(4)2(5)6/h4-11H,3,12-13H2,1-2H3,(H,21,23);(H,3,4)(H,5,6)