(E)-but-2-enedioic acid; 1-[1-(3-ethylphenyl)pyrrolidin-2-yl]-N,N-dimethyl-methanamine

Systemtic Name: (E)-but-2-enedioic acid; 1-[1-(3-ethylphenyl)pyrrolidin-2-yl]-N,N-dimethyl-methanamine Openeye Name: 1-[1-(3-ethylphenyl)pyrrolidin-2-yl]-N,N-dimethyl-methanamine; fumaric acid CAS Name: (E)-2-butenedioic acid; 1-[1-(3-ethylphenyl)-2-pyrrolidinyl]-N,N-dimethylmethanamine IUPAC Name: (E)-but-2-enedioic acid; 1-[1-(3-ethylphenyl)pyrrolidin-2-yl]-N,N-dimethylmethanamine Traditional Name: [1-(3-ethylphenyl)pyrrolidin-2-yl]methyl-dimethyl-amine; fumaric acid Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)N2CCCC2CN(C)C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CCC1=CC(=CC=C1)N2CCCC2CN(C)C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C15H24N2.C4H4O4/c1-4-13-7-5-8-14(11-13)17-10-6-9-15(17)12-16(2)3;5-3(6)1-2-4(7)8/h5,7-8,11,15H,4,6,9-10,12H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1+