2-azanyl-3-ethylsulfanyl-propanoic acid; hexan-1-amine; hydrochloride

Systemtic Name: 2-azanyl-3-ethylsulfanyl-propanoic acid; hexan-1-amine; hydrochloride Openeye Name: 2-amino-3-ethylsulfanyl-propanoic acid; hexan-1-amine; hydrochloride CAS Name: 2-amino-3-(ethylthio)propanoic acid; 1-hexanamine; hydrochloride IUPAC Name: 2-amino-3-ethylsulfanylpropanoic acid; hexan-1-amine; hydrochloride Traditional Name: 2-amino-3-(ethylthio)propionic acid; hexylamine; hydrochloride Formula: C11H27ClN2O2S MolecularWeight: 286.86228

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN.CCSCC(C(=O)O)N.Cl

Isomeric SMILES

CCCCCCN.CCSCC(C(=O)O)N.Cl

InChI

InChI=1S/C6H15N.C5H11NO2S.ClH/c1-2-3-4-5-6-7;1-2-9-3-4(6)5(7)8;/h2-7H2,1H3;4H,2-3,6H2,1H3,(H,7,8);1H