2-(3-chloranyl-4-hexoxy-phenyl)-5-dodecyl-pyridine

Systemtic Name: 2-(3-chloranyl-4-hexoxy-phenyl)-5-dodecyl-pyridine Openeye Name: 2-(3-chloro-4-hexoxy-phenyl)-5-dodecyl-pyridine CAS Name: 2-(3-chloro-4-hexoxyphenyl)-5-dodecylpyridine IUPAC Name: 2-(3-chloro-4-hexoxyphenyl)-5-dodecylpyridine Traditional Name: 2-(3-chloro-4-hexoxy-phenyl)-5-lauryl-pyridine Formula: C29H44ClNO MolecularWeight: 458.11876

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CN=C(C=C1)C2=CC(=C(C=C2)OCCCCCC)Cl

Isomeric SMILES

CCCCCCCCCCCCC1=CN=C(C=C1)C2=CC(=C(C=C2)OCCCCCC)Cl

InChI

InChI=1S/C29H44ClNO/c1-3-5-7-9-10-11-12-13-14-15-17-25-18-20-28(31-24-25)26-19-21-29(27(30)23-26)32-22-16-8-6-4-2/h18-21,23-24H,3-17,22H2,1-2H3