methyl 6-[4-[4-(8-methoxyoctoxy)phenyl]piperazin-1-yl]pyridine-3-carboxylate

Systemtic Name: methyl 6-[4-[4-(8-methoxyoctoxy)phenyl]piperazin-1-yl]pyridine-3-carboxylate Openeye Name: methyl 6-[4-[4-(8-methoxyoctoxy)phenyl]piperazin-1-yl]pyridine-3-carboxylate CAS Name: 6-[4-[4-(8-methoxyoctoxy)phenyl]-1-piperazinyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[4-[4-(8-methoxyoctoxy)phenyl]piperazin-1-yl]pyridine-3-carboxylate Traditional Name: 6-[4-[4-(8-methoxyoctoxy)phenyl]piperazino]nicotinic acid methyl ester Formula: C26H37N3O4 MolecularWeight: 455.58968

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H37N3O4/c1-31-19-7-5-3-4-6-8-20-33-24-12-10-23(11-13-24)28-15-17-29(18-16-28)25-14-9-22(21-27-25)26(30)32-2/h9-14,21H,3-8,15-20H2,1-2H3