N-[(2S)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propyl]-N-phenyl-naphthalene-2-sulfonamide

Systemtic Name: N-[(2S)-2-oxidanyl-3-pyrrolidin-1-ium-1-yl-propyl]-N-phenyl-naphthalene-2-sulfonamide Openeye Name: N-[(2S)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propyl]-N-phenyl-naphthalene-2-sulfonamide CAS Name: N-[(2S)-2-hydroxy-3-(1-pyrrolidin-1-iumyl)propyl]-N-phenyl-2-naphthalenesulfonamide IUPAC Name: N-[(2S)-2-hydroxy-3-pyrrolidin-1-ium-1-ylpropyl]-N-phenylnaphthalene-2-sulfonamide Traditional Name: N-[(2S)-2-hydroxy-3-pyrrolidin-1-ium-1-yl-propyl]-N-phenyl-naphthalene-2-sulfonamide Formula: C23H27N2O3S+ MolecularWeight: 411.53708

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC(CN(C2=CC=CC=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)O

Isomeric SMILES

C1CC[NH+](C1)C[C@@H](CN(C2=CC=CC=C2)S(=O)(=O)C3=CC4=CC=CC=C4C=C3)O

InChI

InChI=1S/C23H26N2O3S/c26-22(17-24-14-6-7-15-24)18-25(21-10-2-1-3-11-21)29(27,28)23-13-12-19-8-4-5-9-20(19)16-23/h1-5,8-13,16,22,26H,6-7,14-15,17-18H2/p+1/t22-/m0/s1