4-[[(2,5-dimethylphenyl)sulfonylamino]methyl]benzoate

Systemtic Name: 4-[[(2,5-dimethylphenyl)sulfonylamino]methyl]benzoate Openeye Name: 4-[[(2,5-dimethylphenyl)sulfonylamino]methyl]benzoate CAS Name: 4-[[(2,5-dimethylphenyl)sulfonylamino]methyl]benzoate IUPAC Name: 4-[[(2,5-dimethylphenyl)sulfonylamino]methyl]benzoate Traditional Name: 4-[[(2,5-dimethylphenyl)sulfonylamino]methyl]benzoate Formula: C16H16NO4S- MolecularWeight: 318.36754

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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-]

Isomeric SMILES

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

InChI

InChI=1S/C16H17NO4S/c1-11-3-4-12(2)15(9-11)22(20,21)17-10-13-5-7-14(8-6-13)16(18)19/h3-9,17H,10H2,1-2H3,(H,18,19)/p-1