2-(3-chloranyl-4-propoxy-phenyl)-2-heptyl-1H-pyridine

Systemtic Name: 2-(3-chloranyl-4-propoxy-phenyl)-2-heptyl-1H-pyridine Openeye Name: 2-(3-chloro-4-propoxy-phenyl)-2-heptyl-1H-pyridine CAS Name: 2-(3-chloro-4-propoxyphenyl)-2-heptyl-1H-pyridine IUPAC Name: 2-(3-chloro-4-propoxyphenyl)-2-heptyl-1H-pyridine Traditional Name: 2-(3-chloro-4-propoxy-phenyl)-2-heptyl-1H-pyridine Formula: C21H30ClNO MolecularWeight: 347.922

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1(C=CC=CN1)C2=CC(=C(C=C2)OCCC)Cl

Isomeric SMILES

CCCCCCCC1(C=CC=CN1)C2=CC(=C(C=C2)OCCC)Cl

InChI

InChI=1S/C21H30ClNO/c1-3-5-6-7-8-13-21(14-9-10-15-23-21)18-11-12-20(19(22)17-18)24-16-4-2/h9-12,14-15,17,23H,3-8,13,16H2,1-2H3