(E)-but-2-enedioic acid; N',2,2-trimethyl-N-(2-phenylphenyl)propanimidamide

Systemtic Name: (E)-but-2-enedioic acid; N',2,2-trimethyl-N-(2-phenylphenyl)propanimidamide Openeye Name: fumaric acid; N',2,2-trimethyl-N-(2-phenylphenyl)propanamidine CAS Name: (E)-2-butenedioic acid; N',2,2-trimethyl-N-(2-phenylphenyl)propanimidamide IUPAC Name: (E)-but-2-enedioic acid; N',2,2-trimethyl-N-(2-phenylphenyl)propanimidamide Traditional Name: fumaric acid; N',2,2-trimethyl-N-(2-phenylphenyl)propionamidine Formula: C22H26N2O4 MolecularWeight: 382.45284

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=NC)NC1=CC=CC=C1C2=CC=CC=C2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C(=NC)NC1=CC=CC=C1C2=CC=CC=C2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C18H22N2.C4H4O4/c1-18(2,3)17(19-4)20-16-13-9-8-12-15(16)14-10-6-5-7-11-14;5-3(6)1-2-4(7)8/h5-13H,1-4H3,(H,19,20);1-2H,(H,5,6)(H,7,8)/b;2-1+