sodium 6-(4-propan-2-ylpiperazin-1-yl)pyridine-3-carboxylate

Systemtic Name: sodium 6-(4-propan-2-ylpiperazin-1-yl)pyridine-3-carboxylate Openeye Name: sodium 6-(4-isopropylpiperazin-1-yl)pyridine-3-carboxylate CAS Name: sodium 6-(4-propan-2-yl-1-piperazinyl)-3-pyridinecarboxylate IUPAC Name: sodium 6-(4-propan-2-ylpiperazin-1-yl)pyridine-3-carboxylate Traditional Name: sodium 6-(4-isopropylpiperazino)nicotinate Formula: C13H18N3NaO2 MolecularWeight: 271.29069

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)C2=NC=C(C=C2)C(=O)[O-].[Na+]

Isomeric SMILES

CC(C)N1CCN(CC1)C2=NC=C(C=C2)C(=O)[O-].[Na+]

InChI

InChI=1S/C13H19N3O2.Na/c1-10(2)15-5-7-16(8-6-15)12-4-3-11(9-14-12)13(17)18;/h3-4,9-10H,5-8H2,1-2H3,(H,17,18);/q;+1/p-1