[4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 4-ethoxybenzenesulfonate

Systemtic Name: [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 4-ethoxybenzenesulfonate Openeye Name: [4-[methyl(2-thienylsulfonyl)amino]phenyl] 4-ethoxybenzenesulfonate CAS Name: 4-ethoxybenzenesulfonic acid [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] ester IUPAC Name: [4-[methyl(thiophen-2-ylsulfonyl)amino]phenyl] 4-ethoxybenzenesulfonate Traditional Name: 4-ethoxybenzenesulfonic acid [4-[methyl(2-thienylsulfonyl)amino]phenyl] ester Formula: C19H19NO6S3 MolecularWeight: 453.55226

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)N(C)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C19H19NO6S3/c1-3-25-16-10-12-18(13-11-16)29(23,24)26-17-8-6-15(7-9-17)20(2)28(21,22)19-5-4-14-27-19/h4-14H,3H2,1-2H3