(E)-4-[1-[bis(2-oxidanylpropyl)amino]propan-2-yloxy]-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[1-[bis(2-oxidanylpropyl)amino]propan-2-yloxy]-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[2-[bis(2-hydroxypropyl)amino]-1-methyl-ethoxy]-4-oxo-but-2-enoic acid CAS Name: (E)-4-[1-[bis(2-hydroxypropyl)amino]propan-2-yloxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[1-[bis(2-hydroxypropyl)amino]propan-2-yloxy]-4-oxobut-2-enoic acid Traditional Name: (E)-4-[2-[bis(2-hydroxypropyl)amino]-1-methyl-ethoxy]-4-keto-but-2-enoic acid Formula: C13H23NO6 MolecularWeight: 289.32482

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN(CC(C)O)CC(C)OC(=O)C=CC(=O)O)O

Isomeric SMILES

CC(CN(CC(C)O)CC(C)OC(=O)/C=C/C(=O)O)O

InChI

InChI=1S/C13H23NO6/c1-9(15)6-14(7-10(2)16)8-11(3)20-13(19)5-4-12(17)18/h4-5,9-11,15-16H,6-8H2,1-3H3,(H,17,18)/b5-4+