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(E)-but-2-enedioic acid; 1-chloranyl-3-(dimethylamino)propan-2-ol

(E)-but-2-enedioic acid; 1-chloranyl-3-(dimethylamino)propan-2-ol

Systemtic Name:(E)-but-2-enedioic acid; 1-chloranyl-3-(dimethylamino)propan-2-ol
Openeye Name:1-chloro-3-(dimethylamino)propan-2-ol; fumaric acid
CAS Name:(E)-2-butenedioic acid; 1-chloro-3-(dimethylamino)-2-propanol
IUPAC Name:(E)-but-2-enedioic acid; 1-chloro-3-(dimethylamino)propan-2-ol
Traditional Name:1-chloro-3-(dimethylamino)propan-2-ol; fumaric acid
Formula: C9H16ClNO5
MolecularWeight: 253.68004
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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC(CCl)O.C(=CC(=O)O)C(=O)O


Isomeric SMILES

CN(C)CC(CCl)O.C(=C/C(=O)O)\C(=O)O


InChI

InChI=1S/C5H12ClNO.C4H4O4/c1-7(2)4-5(8)3-6;5-3(6)1-2-4(7)8/h5,8H,3-4H2,1-2H3;1-2H,(H,5,6)(H,7,8)/b;2-1+


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