dimethyl 5-[2-[methylsulfonyl-(2-propan-2-ylphenyl)amino]ethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[methylsulfonyl-(2-propan-2-ylphenyl)amino]ethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-(2-isopropyl-N-methylsulfonyl-anilino)acetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-(N-methylsulfonyl-2-propan-2-ylanilino)-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-(N-methylsulfonyl-2-propan-2-ylanilino)acetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-(2-isopropyl-N-mesyl-anilino)acetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H26N2O7S MolecularWeight: 462.51604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N(CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=CC=C1N(CC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)S(=O)(=O)C

InChI

InChI=1S/C22H26N2O7S/c1-14(2)18-8-6-7-9-19(18)24(32(5,28)29)13-20(25)23-17-11-15(21(26)30-3)10-16(12-17)22(27)31-4/h6-12,14H,13H2,1-5H3,(H,23,25)