[5-[[ethylcarbamoyl(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] propane-2-sulfonate

Systemtic Name: [5-[[ethylcarbamoyl(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] propane-2-sulfonate Openeye Name: [5-[[ethylcarbamoyl(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] propane-2-sulfonate CAS Name: 2-propanesulfonic acid IUPAC Name: [5-[[ethylcarbamoyl(2-methoxyethyl)amino]methyl]-2-methoxyphenyl] propane-2-sulfonate Traditional Name: propane-2-sulfonic acid [5-[[ethylcarbamoyl(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C17H28N2O6S MolecularWeight: 388.47902

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N(CCOC)CC1=CC(=C(C=C1)OC)OS(=O)(=O)C(C)C

Isomeric SMILES

CCNC(=O)N(CCOC)CC1=CC(=C(C=C1)OC)OS(=O)(=O)C(C)C

InChI

InChI=1S/C17H28N2O6S/c1-6-18-17(20)19(9-10-23-4)12-14-7-8-15(24-5)16(11-14)25-26(21,22)13(2)3/h7-8,11,13H,6,9-10,12H2,1-5H3,(H,18,20)