(3S,5R)-N-[(4-bromophenyl)methyl]-3,5-dimethyl-adamantan-1-amine

Systemtic Name: (3S,5R)-N-[(4-bromophenyl)methyl]-3,5-dimethyl-adamantan-1-amine Openeye Name: (3S,5R)-N-[(4-bromophenyl)methyl]-3,5-dimethyl-adamantan-1-amine CAS Name: (3S,5R)-N-[(4-bromophenyl)methyl]-3,5-dimethyl-1-adamantanamine IUPAC Name: (3S,5R)-N-[(4-bromophenyl)methyl]-3,5-dimethyladamantan-1-amine Traditional Name: (4-bromobenzyl)-[(3S,5R)-3,5-dimethyl-1-adamantyl]amine Formula: C19H26BrN MolecularWeight: 348.32044

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Descriptors Computed from Structure

Canonical SMILES:

CC12CC3CC(C1)(CC(C3)(C2)NCC4=CC=C(C=C4)Br)C

Isomeric SMILES

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

InChI

InChI=1S/C19H26BrN/c1-17-7-15-8-18(2,11-17)13-19(9-15,12-17)21-10-14-3-5-16(20)6-4-14/h3-6,15,21H,7-13H2,1-2H3/t15?,17-,18+,19?