(2S)-2-azanyl-5-[3-(4-nitrooxypiperidin-1-yl)propoxy]-5-oxidanylidene-pentanoic acid hydrochloride

Systemtic Name: (2S)-2-azanyl-5-[3-(4-nitrooxypiperidin-1-yl)propoxy]-5-oxidanylidene-pentanoic acid hydrochloride Openeye Name: (2S)-2-amino-5-[3-(4-nitrooxy-1-piperidyl)propoxy]-5-oxo-pentanoic acid hydrochloride CAS Name: (2S)-2-amino-5-[3-(4-nitrooxy-1-piperidinyl)propoxy]-5-oxopentanoic acid hydrochloride IUPAC Name: (2S)-2-amino-5-[3-(4-nitrooxypiperidin-1-yl)propoxy]-5-oxopentanoic acid hydrochloride Traditional Name: (2S)-2-amino-5-keto-5-[3-(4-nitrooxypiperidino)propoxy]valeric acid hydrochloride Formula: C13H24ClN3O7 MolecularWeight: 369.79856

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O[N+](=O)[O-])CCCOC(=O)CCC(C(=O)O)N.Cl

Isomeric SMILES

C1CN(CCC1O[N+](=O)[O-])CCCOC(=O)CC[C@@H](C(=O)O)N.Cl

InChI

InChI=1S/C13H23N3O7.ClH/c14-11(13(18)19)2-3-12(17)22-9-1-6-15-7-4-10(5-8-15)23-16(20)21;/h10-11H,1-9,14H2,(H,18,19);1H/t11-;/m0./s1