3-chloranyl-2-(4-octoxyphenyl)-5-octyl-pyridine

Systemtic Name: 3-chloranyl-2-(4-octoxyphenyl)-5-octyl-pyridine Openeye Name: 3-chloro-2-(4-octoxyphenyl)-5-octyl-pyridine CAS Name: 3-chloro-2-(4-octoxyphenyl)-5-octylpyridine IUPAC Name: 3-chloro-2-(4-octoxyphenyl)-5-octylpyridine Traditional Name: 3-chloro-2-(4-octoxyphenyl)-5-octyl-pyridine Formula: C27H40ClNO MolecularWeight: 430.0656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC(=C(N=C1)C2=CC=C(C=C2)OCCCCCCCC)Cl

Isomeric SMILES

CCCCCCCCC1=CC(=C(N=C1)C2=CC=C(C=C2)OCCCCCCCC)Cl

InChI

InChI=1S/C27H40ClNO/c1-3-5-7-9-11-13-15-23-21-26(28)27(29-22-23)24-16-18-25(19-17-24)30-20-14-12-10-8-6-4-2/h16-19,21-22H,3-15,20H2,1-2H3