propyl 2-[2-(3-oxidanylpropyl)phenyl]sulfanyl-4H-pyridine-1-carboxylate

Systemtic Name: propyl 2-[2-(3-oxidanylpropyl)phenyl]sulfanyl-4H-pyridine-1-carboxylate Openeye Name: propyl 2-[2-(3-hydroxypropyl)phenyl]sulfanyl-4H-pyridine-1-carboxylate CAS Name: 2-[[2-(3-hydroxypropyl)phenyl]thio]-4H-pyridine-1-carboxylic acid propyl ester IUPAC Name: propyl 2-[2-(3-hydroxypropyl)phenyl]sulfanyl-4H-pyridine-1-carboxylate Traditional Name: 2-[[2-(3-hydroxypropyl)phenyl]thio]-4H-pyridine-1-carboxylic acid propyl ester Formula: C18H23NO3S MolecularWeight: 333.44512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)N1C=CCC=C1SC2=CC=CC=C2CCCO

Isomeric SMILES

CCCOC(=O)N1C=CCC=C1SC2=CC=CC=C2CCCO

InChI

InChI=1S/C18H23NO3S/c1-2-14-22-18(21)19-12-6-5-11-17(19)23-16-10-4-3-8-15(16)9-7-13-20/h3-4,6,8,10-12,20H,2,5,7,9,13-14H2,1H3