ethyl 2-methyl-3-[2-[methylsulfonyl-(4-phenoxyphenyl)amino]ethanoylamino]benzoate

Systemtic Name: ethyl 2-methyl-3-[2-[methylsulfonyl-(4-phenoxyphenyl)amino]ethanoylamino]benzoate Openeye Name: ethyl 2-methyl-3-[[2-(N-methylsulfonyl-4-phenoxy-anilino)acetyl]amino]benzoate CAS Name: 2-methyl-3-[[2-(N-methylsulfonyl-4-phenoxyanilino)-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-methyl-3-[[2-(N-methylsulfonyl-4-phenoxyanilino)acetyl]amino]benzoate Traditional Name: 3-[[2-(N-mesyl-4-phenoxy-anilino)acetyl]amino]-2-methyl-benzoic acid ethyl ester Formula: C25H26N2O6S MolecularWeight: 482.54874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CC=C1)NC(=O)CN(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=CC=C1)NC(=O)CN(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C)C

InChI

InChI=1S/C25H26N2O6S/c1-4-32-25(29)22-11-8-12-23(18(22)2)26-24(28)17-27(34(3,30)31)19-13-15-21(16-14-19)33-20-9-6-5-7-10-20/h5-16H,4,17H2,1-3H3,(H,26,28)