3-[butyl-(2-oxidanyl-3-prop-2-enoxy-propyl)amino]propanoic acid

Systemtic Name: 3-[butyl-(2-oxidanyl-3-prop-2-enoxy-propyl)amino]propanoic acid Openeye Name: 3-[(3-allyloxy-2-hydroxy-propyl)-butyl-amino]propanoic acid CAS Name: 3-[butyl-(2-hydroxy-3-prop-2-enoxypropyl)amino]propanoic acid IUPAC Name: 3-[butyl-(2-hydroxy-3-prop-2-enoxypropyl)amino]propanoic acid Traditional Name: 3-[(3-allyloxy-2-hydroxy-propyl)-butyl-amino]propionic acid Formula: C13H25NO4 MolecularWeight: 259.3419

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)O)CC(COCC=C)O

Isomeric SMILES

CCCCN(CCC(=O)O)CC(COCC=C)O

InChI

InChI=1S/C13H25NO4/c1-3-5-7-14(8-6-13(16)17)10-12(15)11-18-9-4-2/h4,12,15H,2-3,5-11H2,1H3,(H,16,17)