(E)-but-2-enedioic acid; 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-4,5-dihydro-1H-imidazole

Systemtic Name: (E)-but-2-enedioic acid; 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-4,5-dihydro-1H-imidazole Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methyl]-4,5-dihydro-1H-imidazole; fumaric acid CAS Name: (E)-2-butenedioic acid; 2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole IUPAC Name: (E)-but-2-enedioic acid; 2-[(4-tert-butyl-2,6-dimethylphenyl)methyl]-4,5-dihydro-1H-imidazole Traditional Name: 2-(4-tert-butyl-2,6-dimethyl-benzyl)-2-imidazoline; fumaric acid Formula: C20H28N2O4 MolecularWeight: 360.44732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CC2=NCCN2)C)C(C)(C)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC1=CC(=CC(=C1CC2=NCCN2)C)C(C)(C)C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C16H24N2.C4H4O4/c1-11-8-13(16(3,4)5)9-12(2)14(11)10-15-17-6-7-18-15;5-3(6)1-2-4(7)8/h8-9H,6-7,10H2,1-5H3,(H,17,18);1-2H,(H,5,6)(H,7,8)/b;2-1+