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

Systemtic Name: methyl 2-methyl-3-[2-[(4-phenoxyphenyl)-(phenylsulfonyl)amino]ethanoylamino]benzoate Openeye Name: methyl 3-[[2-[N-(benzenesulfonyl)-4-phenoxy-anilino]acetyl]amino]-2-methyl-benzoate CAS Name: 3-[[2-[N-(benzenesulfonyl)-4-phenoxyanilino]-1-oxoethyl]amino]-2-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[[2-[N-(benzenesulfonyl)-4-phenoxyanilino]acetyl]amino]-2-methylbenzoate Traditional Name: 3-[[2-(N-besyl-4-phenoxy-anilino)acetyl]amino]-2-methyl-benzoic acid methyl ester Formula: C29H26N2O6S MolecularWeight: 530.59154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CN(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CN(C2=CC=C(C=C2)OC3=CC=CC=C3)S(=O)(=O)C4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C29H26N2O6S/c1-21-26(29(33)36-2)14-9-15-27(21)30-28(32)20-31(38(34,35)25-12-7-4-8-13-25)22-16-18-24(19-17-22)37-23-10-5-3-6-11-23/h3-19H,20H2,1-2H3,(H,30,32)