(1R,3S)-5-(4-bromophenyl)adamantan-2-one

Systemtic Name: (1R,3S)-5-(4-bromophenyl)adamantan-2-one Openeye Name: (1R,3S)-5-(4-bromophenyl)adamantan-2-one CAS Name: (1R,3S)-5-(4-bromophenyl)-2-adamantanone IUPAC Name: (1R,3S)-5-(4-bromophenyl)adamantan-2-one Traditional Name: (1R,3S)-5-(4-bromophenyl)adamantan-2-one Formula: C16H17BrO MolecularWeight: 305.20958

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC(C2)(CC1C3=O)C4=CC=C(C=C4)Br

Isomeric SMILES

C1[C@@H]2CC3(C[C@@H](C2=O)CC1C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C16H17BrO/c17-14-3-1-13(2-4-14)16-7-10-5-11(8-16)15(18)12(6-10)9-16/h1-4,10-12H,5-9H2/t10?,11-,12+,16?