5-ethynyl-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-benzoic acid

Systemtic Name: 5-ethynyl-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-benzoic acid Openeye Name: 5-ethynyl-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-benzoic acid CAS Name: 5-ethynyl-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbenzoic acid IUPAC Name: 5-ethynyl-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbenzoic acid Traditional Name: 5-ethynyl-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-benzoic acid Formula: C17H15NO5S MolecularWeight: 345.3697

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NS(=O)(=O)C2=CC=C(C=C2)OC)C(=O)O)C#C

Isomeric SMILES

CC1=CC(=CC(=C1NS(=O)(=O)C2=CC=C(C=C2)OC)C(=O)O)C#C

InChI

InChI=1S/C17H15NO5S/c1-4-12-9-11(2)16(15(10-12)17(19)20)18-24(21,22)14-7-5-13(23-3)6-8-14/h1,5-10,18H,2-3H3,(H,19,20)