[3-[[furan-2-ylmethyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] methanesulfonate

Systemtic Name: [3-[[furan-2-ylmethyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[2-furylmethyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[2-furanylmethyl-[(2-methoxyanilino)-oxomethyl]amino]methyl]phenyl] ester IUPAC Name: [3-[[furan-2-ylmethyl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[2-furfuryl-[(2-methoxyphenyl)carbamoyl]amino]methyl]phenyl] ester Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)N(CC2=CC(=CC=C2)OS(=O)(=O)C)CC3=CC=CO3

Isomeric SMILES

COC1=CC=CC=C1NC(=O)N(CC2=CC(=CC=C2)OS(=O)(=O)C)CC3=CC=CO3

InChI

InChI=1S/C21H22N2O6S/c1-27-20-11-4-3-10-19(20)22-21(24)23(15-18-9-6-12-28-18)14-16-7-5-8-17(13-16)29-30(2,25)26/h3-13H,14-15H2,1-2H3,(H,22,24)