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

Systemtic Name: ethyl 4-[2-[(2,3-dimethylphenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[N-(benzenesulfonyl)-2,3-dimethyl-anilino]acetyl]amino]benzoate CAS Name: 4-[[2-[N-(benzenesulfonyl)-2,3-dimethylanilino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[N-(benzenesulfonyl)-2,3-dimethylanilino]acetyl]amino]benzoate Traditional Name: 4-[[2-(N-besyl-2,3-dimethyl-anilino)acetyl]amino]benzoic acid ethyl ester Formula: C25H26N2O5S MolecularWeight: 466.54934

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C2=CC=CC(=C2C)C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)CN(C2=CC=CC(=C2C)C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H26N2O5S/c1-4-32-25(29)20-13-15-21(16-14-20)26-24(28)17-27(23-12-8-9-18(2)19(23)3)33(30,31)22-10-6-5-7-11-22/h5-16H,4,17H2,1-3H3,(H,26,28)