(E)-but-2-enedioate; 3-ethyl-1,2-dimethyl-4,5-dihydro-1H-imidazole-1,3-diium

Systemtic Name: (E)-but-2-enedioate; 3-ethyl-1,2-dimethyl-4,5-dihydro-1H-imidazole-1,3-diium Openeye Name: (E)-but-2-enedioate; 3-ethyl-1,2-dimethyl-4,5-dihydro-1H-imidazole-1,3-diium CAS Name: (E)-2-butenedioate; 3-ethyl-1,2-dimethyl-4,5-dihydro-1H-imidazole-1,3-diium IUPAC Name: (E)-but-2-enedioate; 3-ethyl-1,2-dimethyl-4,5-dihydro-1H-imidazole-1,3-diium Traditional Name: 1-ethyl-2,3-dimethyl-2-imidazoline-1,3-diium fumarate Formula: C18H34N4O4+2 MolecularWeight: 370.48696

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+]1=C([NH+](CC1)C)C.CC[N+]1=C([NH+](CC1)C)C.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

CC[N+]1=C([NH+](CC1)C)C.CC[N+]1=C([NH+](CC1)C)C.C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/2C7H15N2.C4H4O4/c2*1-4-9-6-5-8(3)7(9)2;5-3(6)1-2-4(7)8/h2*4-6H2,1-3H3;1-2H,(H,5,6)(H,7,8)/q2*+1;/b;;2-1+