(E)-but-2-enedioic acid; 2-dimethylaminoethyl 8-ethyl-3-oxidanylidene-4-oxa-2-azaspiro[4.5]decane-2-carboxylate

Systemtic Name: (E)-but-2-enedioic acid; 2-dimethylaminoethyl 8-ethyl-3-oxidanylidene-4-oxa-2-azaspiro[4.5]decane-2-carboxylate Openeye Name: 2-dimethylaminoethyl 8-ethyl-3-oxo-4-oxa-2-azaspiro[4.5]decane-2-carboxylate; fumaric acid CAS Name: (E)-2-butenedioic acid; 8-ethyl-3-oxo-4-oxa-2-azaspiro[4.5]decane-2-carboxylic acid 2-dimethylaminoethyl ester IUPAC Name: (E)-but-2-enedioic acid; 2-dimethylaminoethyl 8-ethyl-3-oxo-4-oxa-2-azaspiro[4.5]decane-2-carboxylate Traditional Name: 8-ethyl-3-keto-4-oxa-2-azaspiro[4.5]decane-2-carboxylic acid 2-dimethylaminoethyl ester; fumaric acid Formula: C19H30N2O8 MolecularWeight: 414.4501

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2(CC1)CN(C(=O)O2)C(=O)OCCN(C)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCC1CCC2(CC1)CN(C(=O)O2)C(=O)OCCN(C)C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C15H26N2O4.C4H4O4/c1-4-12-5-7-15(8-6-12)11-17(14(19)21-15)13(18)20-10-9-16(2)3;5-3(6)1-2-4(7)8/h12H,4-11H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+