ethanedioic acid; ethyl 2-[[[3-ethoxy-3-oxidanylidene-2-(phenylmethyl)propyl]amino]methyl]-3-phenyl-propanoate

Systemtic Name: ethanedioic acid; ethyl 2-[[[3-ethoxy-3-oxidanylidene-2-(phenylmethyl)propyl]amino]methyl]-3-phenyl-propanoate Openeye Name: ethyl 2-benzyl-3-[(2-benzyl-3-ethoxy-3-oxo-propyl)amino]propanoate; oxalic acid CAS Name: 2-[[[3-ethoxy-3-oxo-2-(phenylmethyl)propyl]amino]methyl]-3-phenylpropanoic acid ethyl ester; oxalic acid IUPAC Name: ethyl 2-benzyl-3-[(2-benzyl-3-ethoxy-3-oxopropyl)amino]propanoate; oxalic acid Traditional Name: 2-benzyl-3-[(2-benzyl-3-ethoxy-3-keto-propyl)amino]propionic acid ethyl ester; oxalic acid Formula: C26H33NO8 MolecularWeight: 487.54212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CC=CC=C1)CNCC(CC2=CC=CC=C2)C(=O)OCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)C(CC1=CC=CC=C1)CNCC(CC2=CC=CC=C2)C(=O)OCC.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H31NO4.C2H2O4/c1-3-28-23(26)21(15-19-11-7-5-8-12-19)17-25-18-22(24(27)29-4-2)16-20-13-9-6-10-14-20;3-1(4)2(5)6/h5-14,21-22,25H,3-4,15-18H2,1-2H3;(H,3,4)(H,5,6)