4-[[6-[bis(2-hydroxyethyl)amino]pyridin-3-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[6-[bis(2-hydroxyethyl)amino]pyridin-3-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[6-[bis(2-hydroxyethyl)amino]-3-pyridyl]amino]-4-oxo-butanoic acid CAS Name: 4-[[6-[bis(2-hydroxyethyl)amino]-3-pyridinyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[6-[bis(2-hydroxyethyl)amino]pyridin-3-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[6-[bis(2-hydroxyethyl)amino]-3-pyridyl]amino]-4-keto-butyric acid Formula: C13H19N3O5 MolecularWeight: 297.30706

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1NC(=O)CCC(=O)O)N(CCO)CCO

Isomeric SMILES

C1=CC(=NC=C1NC(=O)CCC(=O)O)N(CCO)CCO

InChI

InChI=1S/C13H19N3O5/c17-7-5-16(6-8-18)11-2-1-10(9-14-11)15-12(19)3-4-13(20)21/h1-2,9,17-18H,3-8H2,(H,15,19)(H,20,21)