(2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(3-sulfamoylphenyl)propanamide

Systemtic Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(3-sulfamoylphenyl)propanamide Openeye Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(3-sulfamoylphenyl)propanamide CAS Name: (2R)-2-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]-N-(3-sulfamoylphenyl)propanamide IUPAC Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(3-sulfamoylphenyl)propanamide Traditional Name: (2R)-2-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]-N-(3-sulfamoylphenyl)propionamide Formula: C20H27N4O4S+ MolecularWeight: 419.51778

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)[NH+]2CCN(CC2)C3=CC=CC=C3OC

Isomeric SMILES

C[C@H](C(=O)NC1=CC(=CC=C1)S(=O)(=O)N)[NH+]2CCN(CC2)C3=CC=CC=C3OC

InChI

InChI=1S/C20H26N4O4S/c1-15(20(25)22-16-6-5-7-17(14-16)29(21,26)27)23-10-12-24(13-11-23)18-8-3-4-9-19(18)28-2/h3-9,14-15H,10-13H2,1-2H3,(H,22,25)(H2,21,26,27)/p+1/t15-/m1/s1