[3-[[2-methoxyethyl(thiophen-2-ylcarbonyl)amino]methyl]phenyl] propane-2-sulfonate

Systemtic Name: [3-[[2-methoxyethyl(thiophen-2-ylcarbonyl)amino]methyl]phenyl] propane-2-sulfonate Openeye Name: [3-[[2-methoxyethyl(thiophene-2-carbonyl)amino]methyl]phenyl] propane-2-sulfonate CAS Name: 2-propanesulfonic acid IUPAC Name: [3-[[2-methoxyethyl(thiophene-2-carbonyl)amino]methyl]phenyl] propane-2-sulfonate Traditional Name: propane-2-sulfonic acid [3-[[2-methoxyethyl(2-thenoyl)amino]methyl]phenyl] ester Formula: C18H23NO5S2 MolecularWeight: 397.50892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)OC1=CC=CC(=C1)CN(CCOC)C(=O)C2=CC=CS2

Isomeric SMILES

CC(C)S(=O)(=O)OC1=CC=CC(=C1)CN(CCOC)C(=O)C2=CC=CS2

InChI

InChI=1S/C18H23NO5S2/c1-14(2)26(21,22)24-16-7-4-6-15(12-16)13-19(9-10-23-3)18(20)17-8-5-11-25-17/h4-8,11-12,14H,9-10,13H2,1-3H3