(E)-but-2-enedioic acid; 2-(dimethylamino)-1-phenyl-cyclopentan-1-ol

Systemtic Name: (E)-but-2-enedioic acid; 2-(dimethylamino)-1-phenyl-cyclopentan-1-ol Openeye Name: 2-(dimethylamino)-1-phenyl-cyclopentanol; fumaric acid CAS Name: (E)-2-butenedioic acid; 2-(dimethylamino)-1-phenyl-1-cyclopentanol IUPAC Name: (E)-but-2-enedioic acid; 2-(dimethylamino)-1-phenylcyclopentan-1-ol Traditional Name: 2-(dimethylamino)-1-phenyl-cyclopentanol; fumaric acid Formula: C17H23NO5 MolecularWeight: 321.36822

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1CCCC1(C2=CC=CC=C2)O.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CN(C)C1CCCC1(C2=CC=CC=C2)O.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C13H19NO.C4H4O4/c1-14(2)12-9-6-10-13(12,15)11-7-4-3-5-8-11;5-3(6)1-2-4(7)8/h3-5,7-8,12,15H,6,9-10H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+