(5S,7R)-1-bis(chloranyl)phosphoryl-3-(4-methylsulfonylphenyl)adamantane

Systemtic Name: (5S,7R)-1-bis(chloranyl)phosphoryl-3-(4-methylsulfonylphenyl)adamantane Openeye Name: (5S,7R)-1-dichlorophosphoryl-3-(4-methylsulfonylphenyl)adamantane CAS Name: (5S,7R)-1-dichlorophosphoryl-3-(4-methylsulfonylphenyl)adamantane IUPAC Name: (5S,7R)-1-dichlorophosphoryl-3-(4-methylsulfonylphenyl)adamantane Traditional Name: (5S,7R)-1-dichlorophosphoryl-3-(4-mesylphenyl)adamantane Formula: C17H21Cl2O3PS MolecularWeight: 407.291601

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)C23CC4CC(C2)CC(C4)(C3)P(=O)(Cl)Cl

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)C23C[C@H]4C[C@@H](C2)CC(C4)(C3)P(=O)(Cl)Cl

InChI

InChI=1S/C17H21Cl2O3PS/c1-24(21,22)15-4-2-14(3-5-15)16-7-12-6-13(8-16)10-17(9-12,11-16)23(18,19)20/h2-5,12-13H,6-11H2,1H3/t12-,13+,16?,17?