3-[bis[2,3-bis(oxidanyl)propyl]amino]benzoate

Systemtic Name: 3-[bis[2,3-bis(oxidanyl)propyl]amino]benzoate Openeye Name: 3-[bis(2,3-dihydroxypropyl)amino]benzoate CAS Name: 3-[bis(2,3-dihydroxypropyl)amino]benzoate IUPAC Name: 3-[bis(2,3-dihydroxypropyl)amino]benzoate Traditional Name: 3-(diglycerylamino)benzoate Formula: C13H18NO6- MolecularWeight: 284.28512

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N(CC(CO)O)CC(CO)O)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)N(CC(CO)O)CC(CO)O)C(=O)[O-]

InChI

InChI=1S/C13H19NO6/c15-7-11(17)5-14(6-12(18)8-16)10-3-1-2-9(4-10)13(19)20/h1-4,11-12,15-18H,5-8H2,(H,19,20)/p-1