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

Systemtic Name: (3S,5R)-4-chloranyl-1-(4-methoxyphenyl)-4-methyl-adamantane Openeye Name: (3S,5R)-4-chloro-1-(4-methoxyphenyl)-4-methyl-adamantane CAS Name: (3S,5R)-4-chloro-1-(4-methoxyphenyl)-4-methyladamantane IUPAC Name: (3S,5R)-4-chloro-1-(4-methoxyphenyl)-4-methyladamantane Traditional Name: (3S,5R)-4-chloro-1-(4-methoxyphenyl)-4-methyl-adamantane Formula: C18H23ClO MolecularWeight: 290.82762

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23ClO/c1-17(19)14-7-12-8-15(17)11-18(9-12,10-14)13-3-5-16(20-2)6-4-13/h3-6,12,14-15H,7-11H2,1-2H3/t12?,14-,15+,17?,18?