2-[bis[2,3-bis(oxidanyl)propyl]amino]-3-methyl-butanoate; carbamimidoylazanium

Systemtic Name: 2-[bis[2,3-bis(oxidanyl)propyl]amino]-3-methyl-butanoate; carbamimidoylazanium Openeye Name: 2-[bis(2,3-dihydroxypropyl)amino]-3-methyl-butanoate; carbamimidoylammonium CAS Name: 2-[bis(2,3-dihydroxypropyl)amino]-3-methylbutanoate; carbamimidoylammonium IUPAC Name: 2-[bis(2,3-dihydroxypropyl)amino]-3-methylbutanoate; carbamimidoylazanium Traditional Name: amidinoammonium; 2-(diglycerylamino)-3-methyl-butyrate Formula: C12H28N4O6 MolecularWeight: 324.37392

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)[O-])N(CC(CO)O)CC(CO)O.C(=N)([NH3+])N

Isomeric SMILES

CC(C)C(C(=O)[O-])N(CC(CO)O)CC(CO)O.C(=N)([NH3+])N

InChI

InChI=1S/C11H23NO6.CH5N3/c1-7(2)10(11(17)18)12(3-8(15)5-13)4-9(16)6-14;2-1(3)4/h7-10,13-16H,3-6H2,1-2H3,(H,17,18);(H5,2,3,4)