3-(1-adamantylsulfanyl)-2-azanyl-propanoic acid hydrochloride

Systemtic Name: 3-(1-adamantylsulfanyl)-2-azanyl-propanoic acid hydrochloride Openeye Name: 3-(1-adamantylsulfanyl)-2-amino-propanoic acid hydrochloride CAS Name: 3-(1-adamantylthio)-2-aminopropanoic acid hydrochloride IUPAC Name: 3-(1-adamantylsulfanyl)-2-aminopropanoic acid hydrochloride Traditional Name: 3-(1-adamantylthio)-2-amino-propionic acid hydrochloride Formula: C13H22ClNO2S MolecularWeight: 291.83728

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)SCC(C(=O)O)N.Cl

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)SCC(C(=O)O)N.Cl

InChI

InChI=1S/C13H21NO2S.ClH/c14-11(12(15)16)7-17-13-4-8-1-9(5-13)3-10(2-8)6-13;/h8-11H,1-7,14H2,(H,15,16);1H