2-(4-butoxybutoxy)-5-(2-heptan-2-yl-1,3-benzodioxol-5-yl)pyridine

Systemtic Name: 2-(4-butoxybutoxy)-5-(2-heptan-2-yl-1,3-benzodioxol-5-yl)pyridine Openeye Name: 2-(4-butoxybutoxy)-5-[2-(1-methylhexyl)-1,3-benzodioxol-5-yl]pyridine CAS Name: 2-(4-butoxybutoxy)-5-(2-heptan-2-yl-1,3-benzodioxol-5-yl)pyridine IUPAC Name: 2-(4-butoxybutoxy)-5-(2-heptan-2-yl-1,3-benzodioxol-5-yl)pyridine Traditional Name: 2-(4-butoxybutoxy)-5-[2-(1-methylhexyl)-1,3-benzodioxol-5-yl]pyridine Formula: C27H39NO4 MolecularWeight: 441.60286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)C1OC2=C(O1)C=C(C=C2)C3=CN=C(C=C3)OCCCCOCCCC

Isomeric SMILES

CCCCCC(C)C1OC2=C(O1)C=C(C=C2)C3=CN=C(C=C3)OCCCCOCCCC

InChI

InChI=1S/C27H39NO4/c1-4-6-8-11-21(3)27-31-24-14-12-22(19-25(24)32-27)23-13-15-26(28-20-23)30-18-10-9-17-29-16-7-5-2/h12-15,19-21,27H,4-11,16-18H2,1-3H3