[5-[[furan-2-ylmethyl(2-methoxyethanoyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate

Systemtic Name: [5-[[furan-2-ylmethyl(2-methoxyethanoyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate Openeye Name: [5-[[2-furylmethyl-(2-methoxyacetyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [5-[[2-furanylmethyl-(2-methoxy-1-oxoethyl)amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[furan-2-ylmethyl-(2-methoxyacetyl)amino]methyl]-2-methoxyphenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-[[2-furfuryl-(2-methoxyacetyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C18H23NO7S MolecularWeight: 397.44272

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=C(C=CC(=C1)CN(CC2=CC=CO2)C(=O)COC)OC

Isomeric SMILES

CCS(=O)(=O)OC1=C(C=CC(=C1)CN(CC2=CC=CO2)C(=O)COC)OC

InChI

InChI=1S/C18H23NO7S/c1-4-27(21,22)26-17-10-14(7-8-16(17)24-3)11-19(18(20)13-23-2)12-15-6-5-9-25-15/h5-10H,4,11-13H2,1-3H3