methyl 4-[2-[4-[methylsulfonyl-(phenylmethyl)amino]phenoxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-[2-[4-[methylsulfonyl-(phenylmethyl)amino]phenoxy]ethanoylamino]benzoate Openeye Name: methyl 4-[[2-[4-[benzyl(methylsulfonyl)amino]phenoxy]acetyl]amino]benzoate CAS Name: 4-[[2-[4-[methylsulfonyl-(phenylmethyl)amino]phenoxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-[4-[benzyl(methylsulfonyl)amino]phenoxy]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-[benzyl(mesyl)amino]phenoxy]acetyl]amino]benzoic acid methyl ester Formula: C24H24N2O6S MolecularWeight: 468.52216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)N(CC3=CC=CC=C3)S(=O)(=O)C

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC=C(C=C2)N(CC3=CC=CC=C3)S(=O)(=O)C

InChI

InChI=1S/C24H24N2O6S/c1-31-24(28)19-8-10-20(11-9-19)25-23(27)17-32-22-14-12-21(13-15-22)26(33(2,29)30)16-18-6-4-3-5-7-18/h3-15H,16-17H2,1-2H3,(H,25,27)