4-[2-[(4-chlorophenyl)methoxy]phenyl]butyl pyridine-3-carboxylate

Systemtic Name: 4-[2-[(4-chlorophenyl)methoxy]phenyl]butyl pyridine-3-carboxylate Openeye Name: 4-[2-[(4-chlorophenyl)methoxy]phenyl]butyl pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid 4-[2-[(4-chlorophenyl)methoxy]phenyl]butyl ester IUPAC Name: 4-[2-[(4-chlorophenyl)methoxy]phenyl]butyl pyridine-3-carboxylate Traditional Name: nicotinic acid 4-[2-(4-chlorobenzyl)oxyphenyl]butyl ester Formula: C23H22ClNO3 MolecularWeight: 395.87868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CCCCOC(=O)C2=CN=CC=C2)OCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)CCCCOC(=O)C2=CN=CC=C2)OCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C23H22ClNO3/c24-21-12-10-18(11-13-21)17-28-22-9-2-1-6-19(22)7-3-4-15-27-23(26)20-8-5-14-25-16-20/h1-2,5-6,8-14,16H,3-4,7,15,17H2