2-azanyl-3-sulfanyl-propanoic acid; 2-(methylamino)hexanoic acid

Systemtic Name: 2-azanyl-3-sulfanyl-propanoic acid; 2-(methylamino)hexanoic acid Openeye Name: 2-amino-3-sulfanyl-propanoic acid; 2-(methylamino)hexanoic acid CAS Name: 2-amino-3-mercaptopropanoic acid; 2-(methylamino)hexanoic acid IUPAC Name: 2-amino-3-sulfanylpropanoic acid; 2-(methylamino)hexanoic acid Traditional Name: 2-amino-3-mercapto-propionic acid; 2-(methylamino)hexanoic acid Formula: C10H22N2O4S MolecularWeight: 266.35768

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC.C(C(C(=O)O)N)S

Isomeric SMILES

CCCCC(C(=O)O)NC.C(C(C(=O)O)N)S

InChI

InChI=1S/C7H15NO2.C3H7NO2S/c1-3-4-5-6(8-2)7(9)10;4-2(1-7)3(5)6/h6,8H,3-5H2,1-2H3,(H,9,10);2,7H,1,4H2,(H,5,6)