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

Systemtic Name: [5-(diethylamino)-2-[[2-methoxyethanoyl(propan-2-yl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [5-(diethylamino)-2-[[isopropyl-(2-methoxyacetyl)amino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [5-(diethylamino)-2-[[(2-methoxy-1-oxoethyl)-propan-2-ylamino]methyl]phenyl] ester IUPAC Name: [5-(diethylamino)-2-[[(2-methoxyacetyl)-propan-2-ylamino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-(diethylamino)-2-[[isopropyl-(2-methoxyacetyl)amino]methyl]phenyl] ester Formula: C19H32N2O5S MolecularWeight: 400.53278

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=C(C=C1)CN(C(C)C)C(=O)COC)OS(=O)(=O)CC

Isomeric SMILES

CCN(CC)C1=CC(=C(C=C1)CN(C(C)C)C(=O)COC)OS(=O)(=O)CC

InChI

InChI=1S/C19H32N2O5S/c1-7-20(8-2)17-11-10-16(18(12-17)26-27(23,24)9-3)13-21(15(4)5)19(22)14-25-6/h10-12,15H,7-9,13-14H2,1-6H3