4-[[(4-ethoxyphenyl)-(4-methylphenyl)sulfonyl-amino]methyl]benzoic acid

Systemtic Name: 4-[[(4-ethoxyphenyl)-(4-methylphenyl)sulfonyl-amino]methyl]benzoic acid Openeye Name: 4-[[4-ethoxy-N-(p-tolylsulfonyl)anilino]methyl]benzoic acid CAS Name: 4-[(4-ethoxy-N-(4-methylphenyl)sulfonylanilino)methyl]benzoic acid IUPAC Name: 4-[(4-ethoxy-N-(4-methylphenyl)sulfonylanilino)methyl]benzoic acid Traditional Name: 4-[(4-ethoxy-N-tosyl-anilino)methyl]benzoic acid Formula: C23H23NO5S MolecularWeight: 425.49742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(CC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N(CC2=CC=C(C=C2)C(=O)O)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H23NO5S/c1-3-29-21-12-10-20(11-13-21)24(16-18-6-8-19(9-7-18)23(25)26)30(27,28)22-14-4-17(2)5-15-22/h4-15H,3,16H2,1-2H3,(H,25,26)