3-(cyclopropylsulfamoyl)-4-methoxy-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide

Systemtic Name: 3-(cyclopropylsulfamoyl)-4-methoxy-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide Openeye Name: 3-(cyclopropylsulfamoyl)-4-methoxy-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide CAS Name: 3-(cyclopropylsulfamoyl)-4-methoxy-N-[4-(1-pyrrolidin-1-iumylmethyl)phenyl]benzamide IUPAC Name: 3-(cyclopropylsulfamoyl)-4-methoxy-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide Traditional Name: 3-(cyclopropylsulfamoyl)-4-methoxy-N-[4-(pyrrolidin-1-ium-1-ylmethyl)phenyl]benzamide Formula: C22H28N3O4S+ MolecularWeight: 430.54042

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C[NH+]3CCCC3)S(=O)(=O)NC4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)C[NH+]3CCCC3)S(=O)(=O)NC4CC4

InChI

InChI=1S/C22H27N3O4S/c1-29-20-11-6-17(14-21(20)30(27,28)24-19-9-10-19)22(26)23-18-7-4-16(5-8-18)15-25-12-2-3-13-25/h4-8,11,14,19,24H,2-3,9-10,12-13,15H2,1H3,(H,23,26)/p+1