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2-[bis(2-hydroxyethyl)amino]ethanol; 2-nitrononanedioic acid

2-[bis(2-hydroxyethyl)amino]ethanol; 2-nitrononanedioic acid

Systemtic Name:2-[bis(2-hydroxyethyl)amino]ethanol; 2-nitrononanedioic acid
Openeye Name:2-[bis(2-hydroxyethyl)amino]ethanol; 2-nitrononanedioic acid
CAS Name:2-[bis(2-hydroxyethyl)amino]ethanol; 2-nitrononanedioic acid
IUPAC Name:2-[bis(2-hydroxyethyl)amino]ethanol; 2-nitrononanedioic acid
Traditional Name:2-[bis(2-hydroxyethyl)amino]ethanol; 2-nitroazelaic acid
Formula: C21H45N3O12
MolecularWeight: 531.5949
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Descriptors Computed from Structure

Canonical SMILES:

C(CCCC(=O)O)CCC(C(=O)O)[N+](=O)[O-].C(CO)N(CCO)CCO.C(CO)N(CCO)CCO


Isomeric SMILES

C(CCCC(=O)O)CCC(C(=O)O)[N+](=O)[O-].C(CO)N(CCO)CCO.C(CO)N(CCO)CCO


InChI

InChI=1S/C9H15NO6.2C6H15NO3/c11-8(12)6-4-2-1-3-5-7(9(13)14)10(15)16;2*8-4-1-7(2-5-9)3-6-10/h7H,1-6H2,(H,11,12)(H,13,14);2*8-10H,1-6H2


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