(E)-but-2-enedioic acid; 5-phenyl-4,5-dihydro-1,3-oxazol-2-amine

Systemtic Name: (E)-but-2-enedioic acid; 5-phenyl-4,5-dihydro-1,3-oxazol-2-amine Openeye Name: fumaric acid; 5-phenyl-4,5-dihydrooxazol-2-amine CAS Name: (E)-2-butenedioic acid; 5-phenyl-4,5-dihydrooxazol-2-amine IUPAC Name: (E)-but-2-enedioic acid; 5-phenyl-4,5-dihydro-1,3-oxazol-2-amine Traditional Name: fumaric acid; (5-phenyl-2-oxazolin-2-yl)amine Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=N1)N)C2=CC=CC=C2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C1C(OC(=N1)N)C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C9H10N2O.C4H4O4/c10-9-11-6-8(12-9)7-4-2-1-3-5-7;5-3(6)1-2-4(7)8/h1-5,8H,6H2,(H2,10,11);1-2H,(H,5,6)(H,7,8)/b;2-1+