2-[4-(3-oxidanylpropyl)piperazin-1-yl]pyridine-3-carboxylic acid

Systemtic Name: 2-[4-(3-oxidanylpropyl)piperazin-1-yl]pyridine-3-carboxylic acid Openeye Name: 2-[4-(3-hydroxypropyl)piperazin-1-yl]pyridine-3-carboxylic acid CAS Name: 2-[4-(3-hydroxypropyl)-1-piperazinyl]-3-pyridinecarboxylic acid IUPAC Name: 2-[4-(3-hydroxypropyl)piperazin-1-yl]pyridine-3-carboxylic acid Traditional Name: 2-[4-(3-hydroxypropyl)piperazino]nicotinic acid Formula: C13H19N3O3 MolecularWeight: 265.30826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCO)C2=C(C=CC=N2)C(=O)O

Isomeric SMILES

C1CN(CCN1CCCO)C2=C(C=CC=N2)C(=O)O

InChI

InChI=1S/C13H19N3O3/c17-10-2-5-15-6-8-16(9-7-15)12-11(13(18)19)3-1-4-14-12/h1,3-4,17H,2,5-10H2,(H,18,19)