[2-methoxy-5-[[2-methoxyethanoyl(propan-2-yl)amino]methyl]phenyl] ethanesulfonate

Systemtic Name: [2-methoxy-5-[[2-methoxyethanoyl(propan-2-yl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [5-[[isopropyl-(2-methoxyacetyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [2-methoxy-5-[[(2-methoxy-1-oxoethyl)-propan-2-ylamino]methyl]phenyl] ester IUPAC Name: [2-methoxy-5-[[(2-methoxyacetyl)-propan-2-ylamino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-[[isopropyl-(2-methoxyacetyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C16H25NO6S MolecularWeight: 359.4378

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=C(C=CC(=C1)CN(C(C)C)C(=O)COC)OC

Isomeric SMILES

CCS(=O)(=O)OC1=C(C=CC(=C1)CN(C(C)C)C(=O)COC)OC

InChI

InChI=1S/C16H25NO6S/c1-6-24(19,20)23-15-9-13(7-8-14(15)22-5)10-17(12(2)3)16(18)11-21-4/h7-9,12H,6,10-11H2,1-5H3