1-(1-adamantyl)-N-[[2-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl]ethanamine

Systemtic Name: 1-(1-adamantyl)-N-[[2-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl]ethanamine Openeye Name: 1-(1-adamantyl)-N-[[2-[(4-chlorophenyl)methoxy]-3-ethoxy-phenyl]methyl]ethanamine CAS Name: 1-(1-adamantyl)-N-[[2-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl]ethanamine IUPAC Name: 1-(1-adamantyl)-N-[[2-[(4-chlorophenyl)methoxy]-3-ethoxyphenyl]methyl]ethanamine Traditional Name: 1-(1-adamantyl)ethyl-[2-(4-chlorobenzyl)oxy-3-ethoxy-benzyl]amine Formula: C28H36ClNO2 MolecularWeight: 454.04394

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1OCC2=CC=C(C=C2)Cl)CNC(C)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC1=CC=CC(=C1OCC2=CC=C(C=C2)Cl)CNC(C)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C28H36ClNO2/c1-3-31-26-6-4-5-24(27(26)32-18-20-7-9-25(29)10-8-20)17-30-19(2)28-14-21-11-22(15-28)13-23(12-21)16-28/h4-10,19,21-23,30H,3,11-18H2,1-2H3