3-[(2,5-dimethylphenyl)sulfonylamino]-4-methyl-benzoate

Systemtic Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-4-methyl-benzoate Openeye Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-4-methyl-benzoate CAS Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-4-methylbenzoate IUPAC Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-4-methylbenzoate Traditional Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-4-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)NC2=C(C=CC(=C2)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=C(C=CC(=C2)C(=O)[O-])C

InChI

InChI=1S/C16H17NO4S/c1-10-4-5-12(3)15(8-10)22(20,21)17-14-9-13(16(18)19)7-6-11(14)2/h4-9,17H,1-3H3,(H,18,19)/p-1