ethyl 4-[2-[(3,4-dimethoxyphenyl)sulfonyl-(3,5-dimethylphenyl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(3,4-dimethoxyphenyl)sulfonyl-(3,5-dimethylphenyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-(N-(3,4-dimethoxyphenyl)sulfonyl-3,5-dimethyl-anilino)acetyl]amino]benzoate CAS Name: 4-[[2-(N-(3,4-dimethoxyphenyl)sulfonyl-3,5-dimethylanilino)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(N-(3,4-dimethoxyphenyl)sulfonyl-3,5-dimethylanilino)acetyl]amino]benzoate Traditional Name: 4-[[2-(N-(3,4-dimethoxyphenyl)sulfonyl-3,5-dimethyl-anilino)acetyl]amino]benzoic acid ethyl ester Formula: C27H30N2O7S MolecularWeight: 526.6013

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H30N2O7S/c1-6-36-27(31)20-7-9-21(10-8-20)28-26(30)17-29(22-14-18(2)13-19(3)15-22)37(32,33)23-11-12-24(34-4)25(16-23)35-5/h7-16H,6,17H2,1-5H3,(H,28,30)