3-[(3,4-dipropoxyphenyl)methyl]-3-azabicyclo[2.2.2]octane

Systemtic Name: 3-[(3,4-dipropoxyphenyl)methyl]-3-azabicyclo[2.2.2]octane Openeye Name: 3-[(3,4-dipropoxyphenyl)methyl]-3-azabicyclo[2.2.2]octane CAS Name: 3-[(3,4-dipropoxyphenyl)methyl]-3-azabicyclo[2.2.2]octane IUPAC Name: 3-[(3,4-dipropoxyphenyl)methyl]-3-azabicyclo[2.2.2]octane Traditional Name: 3-(3,4-dipropoxybenzyl)-3-azabicyclo[2.2.2]octane Formula: C20H31NO2 MolecularWeight: 317.46564

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CN2CC3CCC2CC3)OCCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CN2CC3CCC2CC3)OCCC

InChI

InChI=1S/C20H31NO2/c1-3-11-22-19-10-7-17(13-20(19)23-12-4-2)15-21-14-16-5-8-18(21)9-6-16/h7,10,13,16,18H,3-6,8-9,11-12,14-15H2,1-2H3