(2S)-2-azanyl-5-[2-(2-nitrooxyethylsulfonyl)ethoxy]-5-oxidanylidene-pentanoic acid hydrochloride

Systemtic Name: (2S)-2-azanyl-5-[2-(2-nitrooxyethylsulfonyl)ethoxy]-5-oxidanylidene-pentanoic acid hydrochloride Openeye Name: (2S)-2-amino-5-[2-(2-nitrooxyethylsulfonyl)ethoxy]-5-oxo-pentanoic acid hydrochloride CAS Name: (2S)-2-amino-5-[2-(2-nitrooxyethylsulfonyl)ethoxy]-5-oxopentanoic acid hydrochloride IUPAC Name: (2S)-2-amino-5-[2-(2-nitrooxyethylsulfonyl)ethoxy]-5-oxopentanoic acid hydrochloride Traditional Name: (2S)-2-amino-5-keto-5-[2-(2-nitrooxyethylsulfonyl)ethoxy]valeric acid hydrochloride Formula: C9H17ClN2O9S MolecularWeight: 364.75728

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)OCCS(=O)(=O)CCO[N+](=O)[O-])C(C(=O)O)N.Cl

Isomeric SMILES

C(CC(=O)OCCS(=O)(=O)CCO[N+](=O)[O-])[C@@H](C(=O)O)N.Cl

InChI

InChI=1S/C9H16N2O9S.ClH/c10-7(9(13)14)1-2-8(12)19-3-5-21(17,18)6-4-20-11(15)16;/h7H,1-6,10H2,(H,13,14);1H/t7-;/m0./s1