2-[2-[(3,4-dimethylphenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate

Systemtic Name: 2-[2-[(3,4-dimethylphenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: 2-[[2-[N-(benzenesulfonyl)-3,4-dimethyl-anilino]acetyl]amino]benzoate CAS Name: 2-[[2-[N-(benzenesulfonyl)-3,4-dimethylanilino]-1-oxoethyl]amino]benzoate IUPAC Name: 2-[[2-[N-(benzenesulfonyl)-3,4-dimethylanilino]acetyl]amino]benzoate Traditional Name: 2-[[2-(N-besyl-3,4-dimethyl-anilino)acetyl]amino]benzoate Formula: C23H21N2O5S- MolecularWeight: 437.48824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)[O-])S(=O)(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)[O-])S(=O)(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C23H22N2O5S/c1-16-12-13-18(14-17(16)2)25(31(29,30)19-8-4-3-5-9-19)15-22(26)24-21-11-7-6-10-20(21)23(27)28/h3-14H,15H2,1-2H3,(H,24,26)(H,27,28)/p-1