N-[(1R,2S)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide

Systemtic Name: N-[(1R,2S)-1-morpholin-4-ium-4-yl-1-phenyl-propan-2-yl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide Openeye Name: N-[(1S,2R)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]-4-pyrrolidin-1-ylsulfonyl-benzenesulfonamide CAS Name: N-[(1R,2S)-1-(4-morpholin-4-iumyl)-1-phenylpropan-2-yl]-4-(1-pyrrolidinylsulfonyl)benzenesulfonamide IUPAC Name: N-[(1R,2S)-1-morpholin-4-ium-4-yl-1-phenylpropan-2-yl]-4-pyrrolidin-1-ylsulfonylbenzenesulfonamide Traditional Name: N-[(1S,2R)-1-methyl-2-morpholin-4-ium-4-yl-2-phenyl-ethyl]-4-pyrrolidinosulfonyl-benzenesulfonamide Formula: C23H32N3O5S2+ MolecularWeight: 494.64728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC=CC=C1)[NH+]2CCOCC2)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

C[C@@H]([C@@H](C1=CC=CC=C1)[NH+]2CCOCC2)NS(=O)(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C23H31N3O5S2/c1-19(23(20-7-3-2-4-8-20)25-15-17-31-18-16-25)24-32(27,28)21-9-11-22(12-10-21)33(29,30)26-13-5-6-14-26/h2-4,7-12,19,23-24H,5-6,13-18H2,1H3/p+1/t19-,23-/m0/s1