(4-carbamimidoylphenyl) 3-[[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfamoyl]benzoate

Systemtic Name: (4-carbamimidoylphenyl) 3-[[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfamoyl]benzoate Openeye Name: (4-carbamimidoylphenyl) 3-[(2-tert-butoxy-2-oxo-ethyl)sulfamoyl]benzoate CAS Name: 3-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]sulfamoyl]benzoic acid (4-carbamimidoylphenyl) ester IUPAC Name: (4-carbamimidoylphenyl) 3-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]sulfamoyl]benzoate Traditional Name: 3-[(2-tert-butoxy-2-keto-ethyl)sulfamoyl]benzoic acid (4-amidinophenyl) ester Formula: C20H23N3O6S MolecularWeight: 433.47812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CNS(=O)(=O)C1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)CNS(=O)(=O)C1=CC=CC(=C1)C(=O)OC2=CC=C(C=C2)C(=N)N

InChI

InChI=1S/C20H23N3O6S/c1-20(2,3)29-17(24)12-23-30(26,27)16-6-4-5-14(11-16)19(25)28-15-9-7-13(8-10-15)18(21)22/h4-11,23H,12H2,1-3H3,(H3,21,22)