(3R,5S)-4-[(4-bromophenyl)amino]adamantan-1-ol

Systemtic Name: (3R,5S)-4-[(4-bromophenyl)amino]adamantan-1-ol Openeye Name: (3R,5S)-4-(4-bromoanilino)adamantan-1-ol CAS Name: (3R,5S)-4-(4-bromoanilino)-1-adamantanol IUPAC Name: (3R,5S)-4-(4-bromoanilino)adamantan-1-ol Traditional Name: (3R,5S)-4-(4-bromoanilino)adamantan-1-ol Formula: C16H20BrNO MolecularWeight: 322.2401

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC(C2)(CC1C3NC4=CC=C(C=C4)Br)O

Isomeric SMILES

C1[C@@H]2CC3(C[C@@H](C2NC4=CC=C(C=C4)Br)CC1C3)O

InChI

InChI=1S/C16H20BrNO/c17-13-1-3-14(4-2-13)18-15-11-5-10-6-12(15)9-16(19,7-10)8-11/h1-4,10-12,15,18-19H,5-9H2/t10?,11-,12+,15?,16?