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

Systemtic Name: [3-[[furan-2-ylcarbonyl(2-methoxyethyl)amino]methyl]phenyl] propane-2-sulfonate Openeye Name: [3-[[furan-2-carbonyl(2-methoxyethyl)amino]methyl]phenyl] propane-2-sulfonate CAS Name: 2-propanesulfonic acid IUPAC Name: [3-[[furan-2-carbonyl(2-methoxyethyl)amino]methyl]phenyl] propane-2-sulfonate Traditional Name: propane-2-sulfonic acid [3-[[2-furoyl(2-methoxyethyl)amino]methyl]phenyl] ester Formula: C18H23NO6S MolecularWeight: 381.44332

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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=CO2

Isomeric SMILES

CC(C)S(=O)(=O)OC1=CC=CC(=C1)CN(CCOC)C(=O)C2=CC=CO2

InChI

InChI=1S/C18H23NO6S/c1-14(2)26(21,22)25-16-7-4-6-15(12-16)13-19(9-11-23-3)18(20)17-8-5-10-24-17/h4-8,10,12,14H,9,11,13H2,1-3H3