3-[2,5-bis(azanyl)pentanoyloxy]-4-(trimethylazaniumyl)butanoate dihydrochloride

Systemtic Name: 3-[2,5-bis(azanyl)pentanoyloxy]-4-(trimethylazaniumyl)butanoate dihydrochloride Openeye Name: 3-(2,5-diaminopentanoyloxy)-4-(trimethylammonio)butanoate dihydrochloride CAS Name: 3-(2,5-diamino-1-oxopentoxy)-4-(trimethylammonio)butanoate dihydrochloride IUPAC Name: 3-(2,5-diaminopentanoyloxy)-4-(trimethylazaniumyl)butanoate dihydrochloride Traditional Name: 3-(2,5-diaminopentanoyloxy)-4-(trimethylammonio)butyrate dihydrochloride Formula: C12H27Cl2N3O4 MolecularWeight: 348.26648

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)[O-])OC(=O)C(CCCN)N.Cl.Cl

Isomeric SMILES

C[N+](C)(C)CC(CC(=O)[O-])OC(=O)C(CCCN)N.Cl.Cl

InChI

InChI=1S/C12H25N3O4.2ClH/c1-15(2,3)8-9(7-11(16)17)19-12(18)10(14)5-4-6-13;;/h9-10H,4-8,13-14H2,1-3H3;2*1H