(E)-but-2-enedioic acid; 2-[4-tert-butyl-1-(cyclohexylmethyl)cyclohexyl]oxy-N,N-dimethyl-ethanamine

Systemtic Name: (E)-but-2-enedioic acid; 2-[4-tert-butyl-1-(cyclohexylmethyl)cyclohexyl]oxy-N,N-dimethyl-ethanamine Openeye Name: 2-[4-tert-butyl-1-(cyclohexylmethyl)cyclohexoxy]-N,N-dimethyl-ethanamine; fumaric acid CAS Name: (E)-2-butenedioic acid; 2-[4-tert-butyl-1-(cyclohexylmethyl)cyclohexyl]oxy-N,N-dimethylethanamine IUPAC Name: (E)-but-2-enedioic acid; 2-[4-tert-butyl-1-(cyclohexylmethyl)cyclohexyl]oxy-N,N-dimethylethanamine Traditional Name: 2-[4-tert-butyl-1-(cyclohexylmethyl)cyclohexoxy]ethyl-dimethyl-amine; fumaric acid Formula: C25H45NO5 MolecularWeight: 439.6285

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(CC1)(CC2CCCCC2)OCCN(C)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(C)(C)C1CCC(CC1)(CC2CCCCC2)OCCN(C)C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C21H41NO.C4H4O4/c1-20(2,3)19-11-13-21(14-12-19,23-16-15-22(4)5)17-18-9-7-6-8-10-18;5-3(6)1-2-4(7)8/h18-19H,6-17H2,1-5H3;1-2H,(H,5,6)(H,7,8)/b;2-1+