methyl 4-chloranyl-3-[2-[(4-methoxyphenyl)sulfonyl-phenyl-amino]ethanoylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[2-[(4-methoxyphenyl)sulfonyl-phenyl-amino]ethanoylamino]benzoate Openeye Name: methyl 4-chloro-3-[[2-(N-(4-methoxyphenyl)sulfonylanilino)acetyl]amino]benzoate CAS Name: 4-chloro-3-[[2-(N-(4-methoxyphenyl)sulfonylanilino)-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[[2-(N-(4-methoxyphenyl)sulfonylanilino)acetyl]amino]benzoate Traditional Name: 4-chloro-3-[[2-(N-(4-methoxyphenyl)sulfonylanilino)acetyl]amino]benzoic acid methyl ester Formula: C23H21ClN2O6S MolecularWeight: 488.94064

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=C(C=CC(=C2)C(=O)OC)Cl)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=C(C=CC(=C2)C(=O)OC)Cl)C3=CC=CC=C3

InChI

InChI=1S/C23H21ClN2O6S/c1-31-18-9-11-19(12-10-18)33(29,30)26(17-6-4-3-5-7-17)15-22(27)25-21-14-16(23(28)32-2)8-13-20(21)24/h3-14H,15H2,1-2H3,(H,25,27)