N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(phenylsulfonylamino)benzamide

Systemtic Name: N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]-4-(phenylsulfonylamino)benzamide Openeye Name: 4-(benzenesulfonamido)-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide CAS Name: 4-(benzenesulfonamido)-N-[(2R)-2-(4-methoxyphenyl)-2-(1-pyrrolidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-(benzenesulfonamido)-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-ylethyl]benzamide Traditional Name: 4-(benzenesulfonamido)-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ium-1-yl-ethyl]benzamide Formula: C26H30N3O4S+ MolecularWeight: 480.5991

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)[NH+]4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC=C3)[NH+]4CCCC4

InChI

InChI=1S/C26H29N3O4S/c1-33-23-15-11-20(12-16-23)25(29-17-5-6-18-29)19-27-26(30)21-9-13-22(14-10-21)28-34(31,32)24-7-3-2-4-8-24/h2-4,7-16,25,28H,5-6,17-19H2,1H3,(H,27,30)/p+1/t25-/m0/s1