[5-[[(2-ethoxyphenyl)carbamoyl-(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate

Systemtic Name: [5-[[(2-ethoxyphenyl)carbamoyl-(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate Openeye Name: [5-[[(2-ethoxyphenyl)carbamoyl-(2-methoxyethyl)amino]methyl]-2-methoxy-phenyl] methanesulfonate CAS Name: methanesulfonic acid [5-[[[(2-ethoxyanilino)-oxomethyl]-(2-methoxyethyl)amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[(2-ethoxyphenyl)carbamoyl-(2-methoxyethyl)amino]methyl]-2-methoxyphenyl] methanesulfonate Traditional Name: methanesulfonic acid [2-methoxy-5-[[2-methoxyethyl(o-phenetylcarbamoyl)amino]methyl]phenyl] ester Formula: C21H28N2O7S MolecularWeight: 452.52122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)N(CCOC)CC2=CC(=C(C=C2)OC)OS(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)N(CCOC)CC2=CC(=C(C=C2)OC)OS(=O)(=O)C

InChI

InChI=1S/C21H28N2O7S/c1-5-29-18-9-7-6-8-17(18)22-21(24)23(12-13-27-2)15-16-10-11-19(28-3)20(14-16)30-31(4,25)26/h6-11,14H,5,12-13,15H2,1-4H3,(H,22,24)