(E)-but-2-enedioic acid; 1,2-dimethyl-3-(5-methyl-2-morpholin-4-yl-phenyl)guanidine

Systemtic Name: (E)-but-2-enedioic acid; 1,2-dimethyl-3-(5-methyl-2-morpholin-4-yl-phenyl)guanidine Openeye Name: 1,2-dimethyl-3-(5-methyl-2-morpholino-phenyl)guanidine; fumaric acid CAS Name: (E)-2-butenedioic acid; 1,2-dimethyl-3-[5-methyl-2-(4-morpholinyl)phenyl]guanidine IUPAC Name: (E)-but-2-enedioic acid; 1,2-dimethyl-3-(5-methyl-2-morpholin-4-ylphenyl)guanidine Traditional Name: 1,2-dimethyl-3-(5-methyl-2-morpholino-phenyl)guanidine; fumaric acid Formula: C18H26N4O5 MolecularWeight: 378.42284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2CCOCC2)NC(=NC)NC.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)N2CCOCC2)NC(=NC)NC.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C14H22N4O.C4H4O4/c1-11-4-5-13(18-6-8-19-9-7-18)12(10-11)17-14(15-2)16-3;5-3(6)1-2-4(7)8/h4-5,10H,6-9H2,1-3H3,(H2,15,16,17);1-2H,(H,5,6)(H,7,8)/b;2-1+