[5-[[furan-2-ylmethyl-(4-methoxyphenyl)carbonyl-amino]methyl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [5-[[furan-2-ylmethyl-(4-methoxyphenyl)carbonyl-amino]methyl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [5-[[2-furylmethyl-(4-methoxybenzoyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[[2-furanylmethyl-[(4-methoxyphenyl)-oxomethyl]amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[furan-2-ylmethyl-(4-methoxybenzoyl)amino]methyl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [5-[[2-furfuryl(p-anisoyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C22H23NO7S MolecularWeight: 445.48552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N(CC2=CC(=C(C=C2)OC)OS(=O)(=O)C)CC3=CC=CO3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N(CC2=CC(=C(C=C2)OC)OS(=O)(=O)C)CC3=CC=CO3

InChI

InChI=1S/C22H23NO7S/c1-27-18-9-7-17(8-10-18)22(24)23(15-19-5-4-12-29-19)14-16-6-11-20(28-2)21(13-16)30-31(3,25)26/h4-13H,14-15H2,1-3H3