(E)-but-2-enedioate; trimethyl(phenyl)azanium

Systemtic Name: (E)-but-2-enedioate; trimethyl(phenyl)azanium Openeye Name: (E)-but-2-enedioate; trimethyl(phenyl)ammonium CAS Name: (E)-2-butenedioate; trimethyl(phenyl)ammonium IUPAC Name: (E)-but-2-enedioate; trimethyl(phenyl)azanium Traditional Name: trimethyl(phenyl)ammonium fumarate Formula: C22H30N2O4 MolecularWeight: 386.4846

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C1=CC=CC=C1.C[N+](C)(C)C1=CC=CC=C1.C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C[N+](C)(C)C1=CC=CC=C1.C[N+](C)(C)C1=CC=CC=C1.C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/2C9H14N.C4H4O4/c2*1-10(2,3)9-7-5-4-6-8-9;5-3(6)1-2-4(7)8/h2*4-8H,1-3H3;1-2H,(H,5,6)(H,7,8)/q2*+1;/p-2/b;;2-1+