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

Systemtic Name: ethyl 2-[2-[(3,4-dimethoxyphenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[N-(benzenesulfonyl)-3,4-dimethoxy-anilino]acetyl]amino]benzoate CAS Name: 2-[[2-[N-(benzenesulfonyl)-3,4-dimethoxyanilino]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[N-(benzenesulfonyl)-3,4-dimethoxyanilino]acetyl]amino]benzoate Traditional Name: 2-[[2-(N-besyl-3,4-dimethoxy-anilino)acetyl]amino]benzoic acid ethyl ester Formula: C25H26N2O7S MolecularWeight: 498.54814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)CN(C2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C25H26N2O7S/c1-4-34-25(29)20-12-8-9-13-21(20)26-24(28)17-27(35(30,31)19-10-6-5-7-11-19)18-14-15-22(32-2)23(16-18)33-3/h5-16H,4,17H2,1-3H3,(H,26,28)