(3R,5S)-N-[(3-methoxy-4-prop-2-enoxy-phenyl)methyl]-3,5-dimethyl-adamantan-1-amine

Systemtic Name: (3R,5S)-N-[(3-methoxy-4-prop-2-enoxy-phenyl)methyl]-3,5-dimethyl-adamantan-1-amine Openeye Name: (3R,5S)-N-[(4-allyloxy-3-methoxy-phenyl)methyl]-3,5-dimethyl-adamantan-1-amine CAS Name: (3R,5S)-N-[(3-methoxy-4-prop-2-enoxyphenyl)methyl]-3,5-dimethyl-1-adamantanamine IUPAC Name: (3R,5S)-N-[(3-methoxy-4-prop-2-enoxyphenyl)methyl]-3,5-dimethyladamantan-1-amine Traditional Name: (4-allyloxy-3-methoxy-benzyl)-[(3R,5S)-3,5-dimethyl-1-adamantyl]amine Formula: C23H33NO2 MolecularWeight: 355.51362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)NCC4=CC(=C(C=C4)OCC=C)OC)C

Isomeric SMILES

C[C@@]12CC3C[C@@](C1)(CC(C3)(C2)NCC4=CC(=C(C=C4)OCC=C)OC)C

InChI

InChI=1S/C23H33NO2/c1-5-8-26-19-7-6-17(9-20(19)25-4)13-24-23-12-18-10-21(2,15-23)14-22(3,11-18)16-23/h5-7,9,18,24H,1,8,10-16H2,2-4H3/t18?,21-,22+,23?