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

Systemtic Name: N,N-diethyl-2-[[1-(4-phenoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]ethanamine Openeye Name: N,N-diethyl-2-[[1-(4-phenoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]ethanamine CAS Name: N,N-diethyl-2-[[1-(4-phenoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]ethanamine IUPAC Name: N,N-diethyl-2-[[1-(4-phenoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]ethanamine Traditional Name: diethyl-[2-[[1-(4-phenoxyphenyl)-1,2,3,4-tetrahydroisoquinolin-6-yl]oxy]ethyl]amine Formula: C27H32N2O2 MolecularWeight: 416.55518

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC2=C(C=C1)C(NCC2)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CCN(CC)CCOC1=CC2=C(C=C1)C(NCC2)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C27H32N2O2/c1-3-29(4-2)18-19-30-25-14-15-26-22(20-25)16-17-28-27(26)21-10-12-24(13-11-21)31-23-8-6-5-7-9-23/h5-15,20,27-28H,3-4,16-19H2,1-2H3