6-[4-[2,3-bis(oxidanyl)propyl]piperazin-1-yl]pyridine-3-carboxylic acid

Systemtic Name: 6-[4-[2,3-bis(oxidanyl)propyl]piperazin-1-yl]pyridine-3-carboxylic acid Openeye Name: 6-[4-(2,3-dihydroxypropyl)piperazin-1-yl]pyridine-3-carboxylic acid CAS Name: 6-[4-(2,3-dihydroxypropyl)-1-piperazinyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[4-(2,3-dihydroxypropyl)piperazin-1-yl]pyridine-3-carboxylic acid Traditional Name: 6-(4-glycerylpiperazino)nicotinic acid Formula: C13H19N3O4 MolecularWeight: 281.30766

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(CO)O)C2=NC=C(C=C2)C(=O)O

Isomeric SMILES

C1CN(CCN1CC(CO)O)C2=NC=C(C=C2)C(=O)O

InChI

InChI=1S/C13H19N3O4/c17-9-11(18)8-15-3-5-16(6-4-15)12-2-1-10(7-14-12)13(19)20/h1-2,7,11,17-18H,3-6,8-9H2,(H,19,20)