2-[[1-(3-butoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]-N,N-diethyl-ethanamine

Systemtic Name: 2-[[1-(3-butoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]-N,N-diethyl-ethanamine Openeye Name: 2-[[1-(3-butoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]-N,N-diethyl-ethanamine CAS Name: 2-[[1-(3-butoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]-N,N-diethylethanamine IUPAC Name: 2-[[1-(3-butoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]-N,N-diethylethanamine Traditional Name: 2-[[1-(3-butoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]ethyl-diethyl-amine Formula: C25H36N2O2 MolecularWeight: 396.56554

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2C3=C(CCN2)C=C(C=C3)OCCN(CC)CC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2C3=C(CCN2)C=C(C=C3)OCCN(CC)CC

InChI

InChI=1S/C25H36N2O2/c1-4-7-16-28-22-10-8-9-21(19-22)25-24-12-11-23(18-20(24)13-14-26-25)29-17-15-27(5-2)6-3/h8-12,18-19,25-26H,4-7,13-17H2,1-3H3