6-[4-[4-(8-methoxyoctoxy)phenyl]piperazin-1-yl]pyridine-3-carboxylic acid

Systemtic Name: 6-[4-[4-(8-methoxyoctoxy)phenyl]piperazin-1-yl]pyridine-3-carboxylic acid Openeye Name: 6-[4-[4-(8-methoxyoctoxy)phenyl]piperazin-1-yl]pyridine-3-carboxylic acid CAS Name: 6-[4-[4-(8-methoxyoctoxy)phenyl]-1-piperazinyl]-3-pyridinecarboxylic acid IUPAC Name: 6-[4-[4-(8-methoxyoctoxy)phenyl]piperazin-1-yl]pyridine-3-carboxylic acid Traditional Name: 6-[4-[4-(8-methoxyoctoxy)phenyl]piperazino]nicotinic acid Formula: C25H35N3O4 MolecularWeight: 441.5631

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Descriptors Computed from Structure

Canonical SMILES:

COCCCCCCCCOC1=CC=C(C=C1)N2CCN(CC2)C3=NC=C(C=C3)C(=O)O

Isomeric SMILES

COCCCCCCCCOC1=CC=C(C=C1)N2CCN(CC2)C3=NC=C(C=C3)C(=O)O

InChI

InChI=1S/C25H35N3O4/c1-31-18-6-4-2-3-5-7-19-32-23-11-9-22(10-12-23)27-14-16-28(17-15-27)24-13-8-21(20-26-24)25(29)30/h8-13,20H,2-7,14-19H2,1H3,(H,29,30)