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

Systemtic Name: ethyl 4-[2-[4-[methylsulfonyl-(phenylmethyl)amino]phenoxy]ethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[4-[benzyl(methylsulfonyl)amino]phenoxy]acetyl]amino]benzoate CAS Name: 4-[[2-[4-[methylsulfonyl-(phenylmethyl)amino]phenoxy]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[4-[benzyl(methylsulfonyl)amino]phenoxy]acetyl]amino]benzoate Traditional Name: 4-[[2-[4-[benzyl(mesyl)amino]phenoxy]acetyl]amino]benzoic acid ethyl ester Formula: C25H26N2O6S MolecularWeight: 482.54874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=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/C25H26N2O6S/c1-3-32-25(29)20-9-11-21(12-10-20)26-24(28)18-33-23-15-13-22(14-16-23)27(34(2,30)31)17-19-7-5-4-6-8-19/h4-16H,3,17-18H2,1-2H3,(H,26,28)