[4-[[butylcarbamoyl(2-methoxyethyl)amino]methyl]phenyl] ethanesulfonate

Systemtic Name: [4-[[butylcarbamoyl(2-methoxyethyl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [4-[[butylcarbamoyl(2-methoxyethyl)amino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [4-[[[butylamino(oxo)methyl]-(2-methoxyethyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[butylcarbamoyl(2-methoxyethyl)amino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [4-[[butylcarbamoyl(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C17H28N2O5S MolecularWeight: 372.47962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(CCOC)CC1=CC=C(C=C1)OS(=O)(=O)CC

Isomeric SMILES

CCCCNC(=O)N(CCOC)CC1=CC=C(C=C1)OS(=O)(=O)CC

InChI

InChI=1S/C17H28N2O5S/c1-4-6-11-18-17(20)19(12-13-23-3)14-15-7-9-16(10-8-15)24-25(21,22)5-2/h7-10H,4-6,11-14H2,1-3H3,(H,18,20)