(2S)-2-azanyl-6-[3-(2-oxidanyldodecan-3-yloxy)propylamino]hexanoic acid hydrochloride

Systemtic Name: (2S)-2-azanyl-6-[3-(2-oxidanyldodecan-3-yloxy)propylamino]hexanoic acid hydrochloride Openeye Name: (2S)-2-amino-6-[3-[1-(1-hydroxyethyl)decoxy]propylamino]hexanoic acid hydrochloride CAS Name: (2S)-2-amino-6-[3-(2-hydroxydodecan-3-yloxy)propylamino]hexanoic acid hydrochloride IUPAC Name: (2S)-2-amino-6-[3-(2-hydroxydodecan-3-yloxy)propylamino]hexanoic acid hydrochloride Traditional Name: (2S)-2-amino-6-[3-[1-(1-hydroxyethyl)decoxy]propylamino]hexanoic acid hydrochloride Formula: C21H45ClN2O4 MolecularWeight: 425.046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C(C)O)OCCCNCCCCC(C(=O)O)N.Cl

Isomeric SMILES

CCCCCCCCCC(C(C)O)OCCCNCCCC[C@@H](C(=O)O)N.Cl

InChI

InChI=1S/C21H44N2O4.ClH/c1-3-4-5-6-7-8-9-14-20(18(2)24)27-17-12-16-23-15-11-10-13-19(22)21(25)26;/h18-20,23-24H,3-17,22H2,1-2H3,(H,25,26);1H/t18?,19-,20?;/m0./s1