(E)-but-2-enedioate; [(E)-2-phenylethenyl]azanium

Systemtic Name: (E)-but-2-enedioate; [(E)-2-phenylethenyl]azanium Openeye Name: (E)-but-2-enedioate; [(E)-styryl]ammonium CAS Name: (E)-2-butenedioate; [(E)-2-phenylethenyl]ammonium IUPAC Name: (E)-but-2-enedioate; [(E)-2-phenylethenyl]azanium Traditional Name: [(E)-styryl]ammonium fumarate Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C[NH3+].C1=CC=C(C=C1)C=C[NH3+].C(=CC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)/C=C/[NH3+].C1=CC=C(C=C1)/C=C/[NH3+].C(=C/C(=O)[O-])\C(=O)[O-]

InChI

InChI=1S/2C8H9N.C4H4O4/c2*9-7-6-8-4-2-1-3-5-8;5-3(6)1-2-4(7)8/h2*1-7H,9H2;1-2H,(H,5,6)(H,7,8)/b2*7-6+;2-1+