2-[(4-ethylphenyl)-(2-methoxy-5-methyl-phenyl)sulfonyl-amino]ethanoic acid

Systemtic Name: 2-[(4-ethylphenyl)-(2-methoxy-5-methyl-phenyl)sulfonyl-amino]ethanoic acid Openeye Name: 2-(4-ethyl-N-(2-methoxy-5-methyl-phenyl)sulfonyl-anilino)acetic acid CAS Name: 2-(4-ethyl-N-(2-methoxy-5-methylphenyl)sulfonylanilino)acetic acid IUPAC Name: 2-(4-ethyl-N-(2-methoxy-5-methylphenyl)sulfonylanilino)acetic acid Traditional Name: 2-(4-ethyl-N-(2-methoxy-5-methyl-phenyl)sulfonyl-anilino)acetic acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC(=O)O)S(=O)(=O)C2=C(C=CC(=C2)C)OC

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC(=O)O)S(=O)(=O)C2=C(C=CC(=C2)C)OC

InChI

InChI=1S/C18H21NO5S/c1-4-14-6-8-15(9-7-14)19(12-18(20)21)25(22,23)17-11-13(2)5-10-16(17)24-3/h5-11H,4,12H2,1-3H3,(H,20,21)