[2-[[5-(diethylsulfamoyl)-2-methoxy-phenyl]amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium

Systemtic Name: [2-[[5-(diethylsulfamoyl)-2-methoxy-phenyl]amino]-2-oxidanylidene-ethyl]-methyl-(phenylmethyl)azanium Openeye Name: benzyl-[2-[5-(diethylsulfamoyl)-2-methoxy-anilino]-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-[5-(diethylsulfamoyl)-2-methoxyanilino]-2-oxoethyl]-methyl-(phenylmethyl)ammonium IUPAC Name: benzyl-[2-[5-(diethylsulfamoyl)-2-methoxyanilino]-2-oxoethyl]-methylazanium Traditional Name: benzyl-[2-[5-(diethylsulfamoyl)-2-methoxy-anilino]-2-keto-ethyl]-methyl-ammonium Formula: C21H30N3O4S+ MolecularWeight: 420.5456

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)NC(=O)C[NH+](C)CC2=CC=CC=C2

InChI

InChI=1S/C21H29N3O4S/c1-5-24(6-2)29(26,27)18-12-13-20(28-4)19(14-18)22-21(25)16-23(3)15-17-10-8-7-9-11-17/h7-14H,5-6,15-16H2,1-4H3,(H,22,25)/p+1