(E)-but-2-enedioic acid; 6-[2-(prop-2-enylamino)propyl]pyridin-3-ol

Systemtic Name: (E)-but-2-enedioic acid; 6-[2-(prop-2-enylamino)propyl]pyridin-3-ol Openeye Name: 6-[2-(allylamino)propyl]pyridin-3-ol; fumaric acid CAS Name: (E)-2-butenedioic acid; 6-[2-(prop-2-enylamino)propyl]-3-pyridinol IUPAC Name: (E)-but-2-enedioic acid; 6-[2-(prop-2-enylamino)propyl]pyridin-3-ol Traditional Name: 6-[2-(allylamino)propyl]pyridin-3-ol; fumaric acid Formula: C15H20N2O5 MolecularWeight: 308.3297

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=NC=C(C=C1)O)NCC=C.C(=CC(=O)O)C(=O)O

Isomeric SMILES

CC(CC1=NC=C(C=C1)O)NCC=C.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C11H16N2O.C4H4O4/c1-3-6-12-9(2)7-10-4-5-11(14)8-13-10;5-3(6)1-2-4(7)8/h3-5,8-9,12,14H,1,6-7H2,2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+