4-butyl-1-[[2-(methoxymethoxy)phenyl]methyl]isoquinoline

Systemtic Name: 4-butyl-1-[[2-(methoxymethoxy)phenyl]methyl]isoquinoline Openeye Name: 4-butyl-1-[[2-(methoxymethoxy)phenyl]methyl]isoquinoline CAS Name: 4-butyl-1-[[2-(methoxymethoxy)phenyl]methyl]isoquinoline IUPAC Name: 4-butyl-1-[[2-(methoxymethoxy)phenyl]methyl]isoquinoline Traditional Name: 4-butyl-1-[2-(methoxymethoxy)benzyl]isoquinoline Formula: C22H25NO2 MolecularWeight: 335.4394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CN=C(C2=CC=CC=C21)CC3=CC=CC=C3OCOC

Isomeric SMILES

CCCCC1=CN=C(C2=CC=CC=C21)CC3=CC=CC=C3OCOC

InChI

InChI=1S/C22H25NO2/c1-3-4-9-18-15-23-21(20-12-7-6-11-19(18)20)14-17-10-5-8-13-22(17)25-16-24-2/h5-8,10-13,15H,3-4,9,14,16H2,1-2H3