4-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]benzoic acid

Systemtic Name: 4-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]benzoic acid Openeye Name: 4-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]benzoic acid CAS Name: 4-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]benzoic acid IUPAC Name: 4-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]benzoic acid Traditional Name: 4-[2-[(2,5-dimethylphenyl)sulfonylamino]ethyl]benzoic acid Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC2=CC=C(C=C2)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C17H19NO4S/c1-12-3-4-13(2)16(11-12)23(21,22)18-10-9-14-5-7-15(8-6-14)17(19)20/h3-8,11,18H,9-10H2,1-2H3,(H,19,20)