(E)-but-2-enedioic acid; N-methyl-1-(3-pyridin-3-yloxypropyl)cyclopropan-1-amine

Systemtic Name: (E)-but-2-enedioic acid; N-methyl-1-(3-pyridin-3-yloxypropyl)cyclopropan-1-amine Openeye Name: fumaric acid; N-methyl-1-[3-(3-pyridyloxy)propyl]cyclopropanamine CAS Name: (E)-2-butenedioic acid; N-methyl-1-[3-(3-pyridinyloxy)propyl]-1-cyclopropanamine IUPAC Name: (E)-but-2-enedioic acid; N-methyl-1-(3-pyridin-3-yloxypropyl)cyclopropan-1-amine Traditional Name: fumaric acid; methyl-[1-[3-(3-pyridyloxy)propyl]cyclopropyl]amine Formula: C16H22N2O5 MolecularWeight: 322.35628

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Descriptors Computed from Structure

Canonical SMILES:

CNC1(CC1)CCCOC2=CN=CC=C2.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CNC1(CC1)CCCOC2=CN=CC=C2.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C12H18N2O.C4H4O4/c1-13-12(6-7-12)5-3-9-15-11-4-2-8-14-10-11;5-3(6)1-2-4(7)8/h2,4,8,10,13H,3,5-7,9H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+