[4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] 3-chloranyladamantane-1-carboxylate

Systemtic Name: [4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] 3-chloranyladamantane-1-carboxylate Openeye Name: [4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] 3-chloroadamantane-1-carboxylate CAS Name: 3-chloro-1-adamantanecarboxylic acid [4-[(2-fluorophenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(2-fluorophenyl)sulfonyl-methylamino]phenyl] 3-chloroadamantane-1-carboxylate Traditional Name: 3-chloroadamantane-1-carboxylic acid [4-[(2-fluorophenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C24H25ClFNO4S MolecularWeight: 477.976003

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC(=O)C23CC4CC(C2)CC(C4)(C3)Cl)S(=O)(=O)C5=CC=CC=C5F

Isomeric SMILES

CN(C1=CC=C(C=C1)OC(=O)C23CC4CC(C2)CC(C4)(C3)Cl)S(=O)(=O)C5=CC=CC=C5F

InChI

InChI=1S/C24H25ClFNO4S/c1-27(32(29,30)21-5-3-2-4-20(21)26)18-6-8-19(9-7-18)31-22(28)23-11-16-10-17(12-23)14-24(25,13-16)15-23/h2-9,16-17H,10-15H2,1H3