(E)-but-2-enedioic acid; [2-(dimethylaminomethyl)phenyl] N,N-dimethylcarbamate

Systemtic Name: (E)-but-2-enedioic acid; [2-(dimethylaminomethyl)phenyl] N,N-dimethylcarbamate Openeye Name: [2-(dimethylaminomethyl)phenyl] N,N-dimethylcarbamate; fumaric acid CAS Name: (E)-2-butenedioic acid; N,N-dimethylcarbamic acid [2-(dimethylaminomethyl)phenyl] ester IUPAC Name: (E)-but-2-enedioic acid; [2-(dimethylaminomethyl)phenyl] N,N-dimethylcarbamate Traditional Name: N,N-dimethylcarbamic acid [2-(dimethylaminomethyl)phenyl] ester; fumaric acid Formula: C16H22N2O6 MolecularWeight: 338.35568

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC=CC=C1OC(=O)N(C)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN(C)CC1=CC=CC=C1OC(=O)N(C)C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C12H18N2O2.C4H4O4/c1-13(2)9-10-7-5-6-8-11(10)16-12(15)14(3)4;5-3(6)1-2-4(7)8/h5-8H,9H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1+