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

Systemtic Name: [5-[[furan-2-ylmethyl(propan-2-ylcarbamoyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate Openeye Name: [5-[[2-furylmethyl(isopropylcarbamoyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [5-[[2-furanylmethyl-[oxo-(propan-2-ylamino)methyl]amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[furan-2-ylmethyl(propan-2-ylcarbamoyl)amino]methyl]-2-methoxyphenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-[[2-furfuryl(isopropylcarbamoyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C19H26N2O6S MolecularWeight: 410.48454

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O6S/c1-5-28(23,24)27-18-11-15(8-9-17(18)25-4)12-21(19(22)20-14(2)3)13-16-7-6-10-26-16/h6-11,14H,5,12-13H2,1-4H3,(H,20,22)