[2-methoxy-5-[[2-methoxyethanoyl(2-methoxyethyl)amino]methyl]phenyl] 4-acetamidobenzenesulfonate

Systemtic Name: [2-methoxy-5-[[2-methoxyethanoyl(2-methoxyethyl)amino]methyl]phenyl] 4-acetamidobenzenesulfonate Openeye Name: [2-methoxy-5-[[(2-methoxyacetyl)-(2-methoxyethyl)amino]methyl]phenyl] 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid [2-methoxy-5-[[2-methoxyethyl-(2-methoxy-1-oxoethyl)amino]methyl]phenyl] ester IUPAC Name: [2-methoxy-5-[[(2-methoxyacetyl)-(2-methoxyethyl)amino]methyl]phenyl] 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid [2-methoxy-5-[[(2-methoxyacetyl)-(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C22H28N2O8S MolecularWeight: 480.53132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC(=C2)CN(CCOC)C(=O)COC)OC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=C(C=CC(=C2)CN(CCOC)C(=O)COC)OC

InChI

InChI=1S/C22H28N2O8S/c1-16(25)23-18-6-8-19(9-7-18)33(27,28)32-21-13-17(5-10-20(21)31-4)14-24(11-12-29-2)22(26)15-30-3/h5-10,13H,11-12,14-15H2,1-4H3,(H,23,25)