(2E)-2-(azanylmethylidene)-5-oxidanyl-hexanoate

Systemtic Name: (2E)-2-(azanylmethylidene)-5-oxidanyl-hexanoate Openeye Name: (2E)-2-(aminomethylene)-5-hydroxy-hexanoate CAS Name: (2E)-2-(aminomethylidene)-5-hydroxyhexanoate IUPAC Name: (2E)-2-(aminomethylidene)-5-hydroxyhexanoate Traditional Name: (E)-3-amino-2-(3-hydroxybutyl)acrylate Formula: C7H12NO3- MolecularWeight: 158.17508

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(=CN)C(=O)[O-])O

Isomeric SMILES

CC(CC/C(=C\N)/C(=O)[O-])O

InChI

InChI=1S/C7H13NO3/c1-5(9)2-3-6(4-8)7(10)11/h4-5,9H,2-3,8H2,1H3,(H,10,11)/p-1/b6-4+