N-[[3-chloranyl-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl]adamantan-2-amine

Systemtic Name: N-[[3-chloranyl-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl]adamantan-2-amine Openeye Name: N-[[3-chloro-4-[(2-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl]adamantan-2-amine CAS Name: N-[[3-chloro-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl]-2-adamantanamine IUPAC Name: N-[[3-chloro-4-[(2-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl]adamantan-2-amine Traditional Name: 2-adamantyl-[3-chloro-4-(2-chlorobenzyl)oxy-5-ethoxy-benzyl]amine Formula: C26H31Cl2NO2 MolecularWeight: 460.43584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNC2C3CC4CC(C3)CC2C4)Cl)OCC5=CC=CC=C5Cl

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNC2C3CC4CC(C3)CC2C4)Cl)OCC5=CC=CC=C5Cl

InChI

InChI=1S/C26H31Cl2NO2/c1-2-30-24-13-18(12-23(28)26(24)31-15-19-5-3-4-6-22(19)27)14-29-25-20-8-16-7-17(10-20)11-21(25)9-16/h3-6,12-13,16-17,20-21,25,29H,2,7-11,14-15H2,1H3