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

Systemtic Name: ethanedioic acid; ethyl 3-[(3-ethoxy-3-oxidanylidene-propyl)amino]-2-phenyl-propanoate Openeye Name: ethyl 3-[(3-ethoxy-3-oxo-propyl)amino]-2-phenyl-propanoate; oxalic acid CAS Name: 3-[(3-ethoxy-3-oxopropyl)amino]-2-phenylpropanoic acid ethyl ester; oxalic acid IUPAC Name: ethyl 3-[(3-ethoxy-3-oxopropyl)amino]-2-phenylpropanoate; oxalic acid Traditional Name: 3-[(3-ethoxy-3-keto-propyl)amino]-2-phenyl-propionic acid ethyl ester; oxalic acid Formula: C18H25NO8 MolecularWeight: 383.393

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNCC(C1=CC=CC=C1)C(=O)OCC.C(=O)(C(=O)O)O

Isomeric SMILES

CCOC(=O)CCNCC(C1=CC=CC=C1)C(=O)OCC.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H23NO4.C2H2O4/c1-3-20-15(18)10-11-17-12-14(16(19)21-4-2)13-8-6-5-7-9-13;3-1(4)2(5)6/h5-9,14,17H,3-4,10-12H2,1-2H3;(H,3,4)(H,5,6)