N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Openeye Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidin-1-iumyl)ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Traditional Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-[(3-nitrophenyl)sulfonylamino]benzamide Formula: C23H25N4O6S+ MolecularWeight: 485.5328

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)C(CNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C4=CC=CO4

Isomeric SMILES

C1CC[NH+](C1)[C@@H](CNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])C4=CC=CO4

InChI

InChI=1S/C23H24N4O6S/c28-23(24-16-21(22-7-4-14-33-22)26-12-1-2-13-26)17-8-10-18(11-9-17)25-34(31,32)20-6-3-5-19(15-20)27(29)30/h3-11,14-15,21,25H,1-2,12-13,16H2,(H,24,28)/p+1/t21-/m0/s1