N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-4-morpholin-4-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-4-morpholin-4-ylsulfonyl-benzenesulfonamide Openeye Name: N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-4-morpholinosulfonyl-benzenesulfonamide CAS Name: N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-4-(4-morpholinylsulfonyl)benzenesulfonamide IUPAC Name: N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-4-morpholin-4-ylsulfonylbenzenesulfonamide Traditional Name: N-[(1R,2R,3S)-2,3-dimethylcyclohexyl]-4-morpholinosulfonyl-benzenesulfonamide Formula: C18H28N2O5S2 MolecularWeight: 416.55532

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

C[C@H]1CCC[C@H]([C@@H]1C)NS(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H28N2O5S2/c1-14-4-3-5-18(15(14)2)19-26(21,22)16-6-8-17(9-7-16)27(23,24)20-10-12-25-13-11-20/h6-9,14-15,18-19H,3-5,10-13H2,1-2H3/t14-,15+,18+/m0/s1