(3S,5R)-4-chloranyl-4-methyl-1-phenyl-adamantane

Systemtic Name: (3S,5R)-4-chloranyl-4-methyl-1-phenyl-adamantane Openeye Name: (3S,5R)-4-chloro-4-methyl-1-phenyl-adamantane CAS Name: (3S,5R)-4-chloro-4-methyl-1-phenyladamantane IUPAC Name: (3S,5R)-4-chloro-4-methyl-1-phenyladamantane Traditional Name: (3S,5R)-4-chloro-4-methyl-1-phenyl-adamantane Formula: C17H21Cl MolecularWeight: 260.80164

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CC3CC1CC(C3)(C2)C4=CC=CC=C4)Cl

Isomeric SMILES

CC1([C@@H]2CC3C[C@H]1CC(C2)(C3)C4=CC=CC=C4)Cl

InChI

InChI=1S/C17H21Cl/c1-16(18)14-7-12-8-15(16)11-17(9-12,10-14)13-5-3-2-4-6-13/h2-6,12,14-15H,7-11H2,1H3/t12?,14-,15+,16?,17?