[4-[[(2-methoxyphenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate

Systemtic Name: [4-[[(2-methoxyphenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate Openeye Name: [4-[[(2-methoxyphenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [4-[[[(2-methoxyanilino)-oxomethyl]-(3-methoxypropyl)amino]methyl]phenyl] ester IUPAC Name: [4-[[(2-methoxyphenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [4-[[(2-methoxyphenyl)carbamoyl-(3-methoxypropyl)amino]methyl]phenyl] ester Formula: C20H26N2O6S MolecularWeight: 422.49524

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)NC2=CC=CC=C2OC

Isomeric SMILES

COCCCN(CC1=CC=C(C=C1)OS(=O)(=O)C)C(=O)NC2=CC=CC=C2OC

InChI

InChI=1S/C20H26N2O6S/c1-26-14-6-13-22(20(23)21-18-7-4-5-8-19(18)27-2)15-16-9-11-17(12-10-16)28-29(3,24)25/h4-5,7-12H,6,13-15H2,1-3H3,(H,21,23)