ethanedioic acid; 4-oxidanyl-N-[2-[(2-oxidanyl-3-phenoxy-propyl)amino]ethyl]benzamide

Systemtic Name: ethanedioic acid; 4-oxidanyl-N-[2-[(2-oxidanyl-3-phenoxy-propyl)amino]ethyl]benzamide Openeye Name: 4-hydroxy-N-[2-[(2-hydroxy-3-phenoxy-propyl)amino]ethyl]benzamide; oxalic acid CAS Name: 4-hydroxy-N-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethyl]benzamide; oxalic acid IUPAC Name: 4-hydroxy-N-[2-[(2-hydroxy-3-phenoxypropyl)amino]ethyl]benzamide; oxalic acid Traditional Name: 4-hydroxy-N-[2-[(2-hydroxy-3-phenoxy-propyl)amino]ethyl]benzamide; oxalic acid Formula: C20H24N2O8 MolecularWeight: 420.41316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(CNCCNC(=O)C2=CC=C(C=C2)O)O.C(=O)(C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)OCC(CNCCNC(=O)C2=CC=C(C=C2)O)O.C(=O)(C(=O)O)O

InChI

InChI=1S/C18H22N2O4.C2H2O4/c21-15-8-6-14(7-9-15)18(23)20-11-10-19-12-16(22)13-24-17-4-2-1-3-5-17;3-1(4)2(5)6/h1-9,16,19,21-22H,10-13H2,(H,20,23);(H,3,4)(H,5,6)