N-[(3-chloranyl-4,5-diethoxy-phenyl)methyl]adamantan-1-amine

Systemtic Name: N-[(3-chloranyl-4,5-diethoxy-phenyl)methyl]adamantan-1-amine Openeye Name: N-[(3-chloro-4,5-diethoxy-phenyl)methyl]adamantan-1-amine CAS Name: N-[(3-chloro-4,5-diethoxyphenyl)methyl]-1-adamantanamine IUPAC Name: N-[(3-chloro-4,5-diethoxyphenyl)methyl]adamantan-1-amine Traditional Name: 1-adamantyl-(3-chloro-4,5-diethoxy-benzyl)amine Formula: C21H30ClNO2 MolecularWeight: 363.9214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)CNC23CC4CC(C2)CC(C4)C3)Cl)OCC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)CNC23CC4CC(C2)CC(C4)C3)Cl)OCC

InChI

InChI=1S/C21H30ClNO2/c1-3-24-19-9-17(8-18(22)20(19)25-4-2)13-23-21-10-14-5-15(11-21)7-16(6-14)12-21/h8-9,14-16,23H,3-7,10-13H2,1-2H3