2-(4-butoxy-3-chloranyl-phenyl)-3-hexyl-pyridine

Systemtic Name: 2-(4-butoxy-3-chloranyl-phenyl)-3-hexyl-pyridine Openeye Name: 2-(4-butoxy-3-chloro-phenyl)-3-hexyl-pyridine CAS Name: 2-(4-butoxy-3-chlorophenyl)-3-hexylpyridine IUPAC Name: 2-(4-butoxy-3-chlorophenyl)-3-hexylpyridine Traditional Name: 2-(4-butoxy-3-chloro-phenyl)-3-hexyl-pyridine Formula: C21H28ClNO MolecularWeight: 345.90612

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(N=CC=C1)C2=CC(=C(C=C2)OCCCC)Cl

Isomeric SMILES

CCCCCCC1=C(N=CC=C1)C2=CC(=C(C=C2)OCCCC)Cl

InChI

InChI=1S/C21H28ClNO/c1-3-5-7-8-10-17-11-9-14-23-21(17)18-12-13-20(19(22)16-18)24-15-6-4-2/h9,11-14,16H,3-8,10,15H2,1-2H3