(E)-but-2-enedioic acid; N,N-dimethyl-3-phenyl-3-pyridin-2-yl-propan-1-amine oxide

Systemtic Name: (E)-but-2-enedioic acid; N,N-dimethyl-3-phenyl-3-pyridin-2-yl-propan-1-amine oxide Openeye Name: N,N-dimethyl-3-phenyl-3-(2-pyridyl)propan-1-amine oxide; fumaric acid CAS Name: (E)-2-butenedioic acid; N,N-dimethyl-3-phenyl-3-(2-pyridinyl)-1-propanamine oxide IUPAC Name: (E)-but-2-enedioic acid; N,N-dimethyl-3-phenyl-3-pyridin-2-ylpropan-1-amine oxide Traditional Name: N,N-dimethyl-3-phenyl-3-(2-pyridyl)propan-1-amine oxide; fumaric acid Formula: C20H24N2O5 MolecularWeight: 372.41496

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCC(C1=CC=CC=C1)C2=CC=CC=N2)[O-].C(=CC(=O)O)C(=O)O

Isomeric SMILES

C[N+](C)(CCC(C1=CC=CC=C1)C2=CC=CC=N2)[O-].C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C16H20N2O.C4H4O4/c1-18(2,19)13-11-15(14-8-4-3-5-9-14)16-10-6-7-12-17-16;5-3(6)1-2-4(7)8/h3-10,12,15H,11,13H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+