(E)-but-2-enedioic acid; 6-(dimethylaminomethyl)-3-methoxy-cyclohex-2-en-1-one

Systemtic Name: (E)-but-2-enedioic acid; 6-(dimethylaminomethyl)-3-methoxy-cyclohex-2-en-1-one Openeye Name: 6-(dimethylaminomethyl)-3-methoxy-cyclohex-2-en-1-one; fumaric acid CAS Name: (E)-2-butenedioic acid; 6-(dimethylaminomethyl)-3-methoxy-1-cyclohex-2-enone IUPAC Name: (E)-but-2-enedioic acid; 6-(dimethylaminomethyl)-3-methoxycyclohex-2-en-1-one Traditional Name: 6-(dimethylaminomethyl)-3-methoxy-cyclohex-2-en-1-one; fumaric acid Formula: C14H21NO6 MolecularWeight: 299.31964

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1CCC(=CC1=O)OC.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN(C)CC1CCC(=CC1=O)OC.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C10H17NO2.C4H4O4/c1-11(2)7-8-4-5-9(13-3)6-10(8)12;5-3(6)1-2-4(7)8/h6,8H,4-5,7H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+