1,3-bis(azanyl)propan-2-ol; 2-sulfobutanedioic acid

Systemtic Name: 1,3-bis(azanyl)propan-2-ol; 2-sulfobutanedioic acid Openeye Name: 1,3-diaminopropan-2-ol; 2-sulfobutanedioic acid CAS Name: 1,3-diamino-2-propanol; 2-sulfobutanedioic acid IUPAC Name: 1,3-diaminopropan-2-ol; 2-sulfobutanedioic acid Traditional Name: 1,3-diaminopropan-2-ol; 2-sulfosuccinic acid Formula: C11H22N2O15S2 MolecularWeight: 486.42678

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Descriptors Computed from Structure

Canonical SMILES:

C(C(C(=O)O)S(=O)(=O)O)C(=O)O.C(C(C(=O)O)S(=O)(=O)O)C(=O)O.C(C(CN)O)N

Isomeric SMILES

C(C(C(=O)O)S(=O)(=O)O)C(=O)O.C(C(C(=O)O)S(=O)(=O)O)C(=O)O.C(C(CN)O)N

InChI

InChI=1S/2C4H6O7S.C3H10N2O/c2*5-3(6)1-2(4(7)8)12(9,10)11;4-1-3(6)2-5/h2*2H,1H2,(H,5,6)(H,7,8)(H,9,10,11);3,6H,1-2,4-5H2