ethyl 3-[2-[(3-bromanyl-4-methoxy-phenyl)sulfonyl-(4-methylphenyl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 3-[2-[(3-bromanyl-4-methoxy-phenyl)sulfonyl-(4-methylphenyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 3-[[2-(N-(3-bromo-4-methoxy-phenyl)sulfonyl-4-methyl-anilino)acetyl]amino]benzoate CAS Name: 3-[[2-(N-(3-bromo-4-methoxyphenyl)sulfonyl-4-methylanilino)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[2-(N-(3-bromo-4-methoxyphenyl)sulfonyl-4-methylanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-(N-(3-bromo-4-methoxy-phenyl)sulfonyl-4-methyl-anilino)acetyl]amino]benzoic acid ethyl ester Formula: C25H25BrN2O6S MolecularWeight: 561.4448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H25BrN2O6S/c1-4-34-25(30)18-6-5-7-19(14-18)27-24(29)16-28(20-10-8-17(2)9-11-20)35(31,32)21-12-13-23(33-3)22(26)15-21/h5-15H,4,16H2,1-3H3,(H,27,29)