(Z)-but-2-enedioic acid; (E)-N'-(3-morpholin-4-yl-2-oxidanyl-propyl)-N-oxidanyl-3-phenyl-prop-2-enimidamide

Systemtic Name: (Z)-but-2-enedioic acid; (E)-N'-(3-morpholin-4-yl-2-oxidanyl-propyl)-N-oxidanyl-3-phenyl-prop-2-enimidamide Openeye Name: (E)-N-hydroxy-N'-(2-hydroxy-3-morpholino-propyl)-3-phenyl-prop-2-enamidine; maleic acid CAS Name: (Z)-2-butenedioic acid; (E)-N-hydroxy-N'-[2-hydroxy-3-(4-morpholinyl)propyl]-3-phenyl-2-propenimidamide IUPAC Name: (Z)-but-2-enedioic acid; (E)-N-hydroxy-N'-(2-hydroxy-3-morpholin-4-ylpropyl)-3-phenylprop-2-enimidamide Traditional Name: (E)-N-hydroxy-N'-(2-hydroxy-3-morpholino-propyl)-3-phenyl-acrylamidine; maleic acid Formula: C20H27N3O7 MolecularWeight: 421.44428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC(CN=C(C=CC2=CC=CC=C2)NO)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1COCCN1CC(CN=C(/C=C/C2=CC=CC=C2)NO)O.C(=C\C(=O)O)\C(=O)O

InChI

InChI=1S/C16H23N3O3.C4H4O4/c20-15(13-19-8-10-22-11-9-19)12-17-16(18-21)7-6-14-4-2-1-3-5-14;5-3(6)1-2-4(7)8/h1-7,15,20-21H,8-13H2,(H,17,18);1-2H,(H,5,6)(H,7,8)/b7-6+;2-1-