2-[(2-methylpropan-2-yl)oxycarbonyl-[2-oxidanylidene-2-[(4-phenylmethoxyphenyl)amino]ethyl]amino]ethyl methanesulfonate

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-[2-oxidanylidene-2-[(4-phenylmethoxyphenyl)amino]ethyl]amino]ethyl methanesulfonate Openeye Name: 2-[[2-(4-benzyloxyanilino)-2-oxo-ethyl]-tert-butoxycarbonyl-amino]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]-[2-oxo-2-(4-phenylmethoxyanilino)ethyl]amino]ethyl ester IUPAC Name: 2-[(2-methylpropan-2-yl)oxycarbonyl-[2-oxo-2-(4-phenylmethoxyanilino)ethyl]amino]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[[2-(4-benzoxyanilino)-2-keto-ethyl]-tert-butoxycarbonyl-amino]ethyl ester Formula: C23H30N2O7S MolecularWeight: 478.5585

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(CCOS(=O)(=O)C)CC(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)(C)OC(=O)N(CCOS(=O)(=O)C)CC(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C23H30N2O7S/c1-23(2,3)32-22(27)25(14-15-31-33(4,28)29)16-21(26)24-19-10-12-20(13-11-19)30-17-18-8-6-5-7-9-18/h5-13H,14-17H2,1-4H3,(H,24,26)