dimethyl 2-[[2-[methylsulfonyl-(phenylmethyl)amino]phenyl]carbonylamino]benzene-1,4-dicarboxylate

Systemtic Name: dimethyl 2-[[2-[methylsulfonyl-(phenylmethyl)amino]phenyl]carbonylamino]benzene-1,4-dicarboxylate Openeye Name: dimethyl 2-[[2-[benzyl(methylsulfonyl)amino]benzoyl]amino]benzene-1,4-dicarboxylate CAS Name: 2-[[[2-[methylsulfonyl-(phenylmethyl)amino]phenyl]-oxomethyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[[2-[benzyl(methylsulfonyl)amino]benzoyl]amino]benzene-1,4-dicarboxylate Traditional Name: 2-[[2-[benzyl(mesyl)amino]benzoyl]amino]benzene-1,4-dicarboxylic acid dimethyl ester Formula: C25H24N2O7S MolecularWeight: 496.53226

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2=CC=CC=C2N(CC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)C2=CC=CC=C2N(CC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C25H24N2O7S/c1-33-24(29)18-13-14-19(25(30)34-2)21(15-18)26-23(28)20-11-7-8-12-22(20)27(35(3,31)32)16-17-9-5-4-6-10-17/h4-15H,16H2,1-3H3,(H,26,28)