4-[[(2-methoxyphenyl)sulfonylamino]methyl]-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 4-[[(2-methoxyphenyl)sulfonylamino]methyl]-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 4-[[(2-methoxyphenyl)sulfonylamino]methyl]-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 4-[[(2-methoxyphenyl)sulfonylamino]methyl]-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]benzamide IUPAC Name: 4-[[(2-methoxyphenyl)sulfonylamino]methyl]-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 4-[[(2-methoxyphenyl)sulfonylamino]methyl]-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]benzamide Formula: C27H32N3O4S+ MolecularWeight: 494.62568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1S(=O)(=O)NCC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3C[NH+]4CCCC4

Isomeric SMILES

COC1=CC=CC=C1S(=O)(=O)NCC2=CC=C(C=C2)C(=O)NCC3=CC=CC=C3C[NH+]4CCCC4

InChI

InChI=1S/C27H31N3O4S/c1-34-25-10-4-5-11-26(25)35(32,33)29-18-21-12-14-22(15-13-21)27(31)28-19-23-8-2-3-9-24(23)20-30-16-6-7-17-30/h2-5,8-15,29H,6-7,16-20H2,1H3,(H,28,31)/p+1