4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzoate

Systemtic Name: 4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzoate Openeye Name: 4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzoate CAS Name: 4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzoate IUPAC Name: 4-[[(2,4,6-trimethylphenyl)sulfonylamino]methyl]benzoate Traditional Name: 4-[(mesitylsulfonylamino)methyl]benzoate Formula: C17H18NO4S- MolecularWeight: 332.39412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCC2=CC=C(C=C2)C(=O)[O-])C

InChI

InChI=1S/C17H19NO4S/c1-11-8-12(2)16(13(3)9-11)23(21,22)18-10-14-4-6-15(7-5-14)17(19)20/h4-9,18H,10H2,1-3H3,(H,19,20)/p-1