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

Systemtic Name: ethanedioic acid; methyl 4-[2-[ethyl-(phenylmethyl)amino]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[benzyl(ethyl)amino]acetyl]amino]benzoate; oxalic acid CAS Name: 4-[[2-[ethyl-(phenylmethyl)amino]-1-oxoethyl]amino]benzoic acid methyl ester; oxalic acid IUPAC Name: methyl 4-[[2-[benzyl(ethyl)amino]acetyl]amino]benzoate; oxalic acid Traditional Name: 4-[[2-[benzyl(ethyl)amino]acetyl]amino]benzoic acid methyl ester; oxalic acid Formula: C21H24N2O7 MolecularWeight: 416.42446

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)CC(=O)NC2=CC=C(C=C2)C(=O)OC.C(=O)(C(=O)O)O

Isomeric SMILES

CCN(CC1=CC=CC=C1)CC(=O)NC2=CC=C(C=C2)C(=O)OC.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H22N2O3.C2H2O4/c1-3-21(13-15-7-5-4-6-8-15)14-18(22)20-17-11-9-16(10-12-17)19(23)24-2;3-1(4)2(5)6/h4-12H,3,13-14H2,1-2H3,(H,20,22);(H,3,4)(H,5,6)