[3-[[(2,4-dimethoxyphenyl)carbamoyl-propan-2-yl-amino]methyl]phenyl] methanesulfonate

Systemtic Name: [3-[[(2,4-dimethoxyphenyl)carbamoyl-propan-2-yl-amino]methyl]phenyl] methanesulfonate Openeye Name: [3-[[(2,4-dimethoxyphenyl)carbamoyl-isopropyl-amino]methyl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-[[[(2,4-dimethoxyanilino)-oxomethyl]-propan-2-ylamino]methyl]phenyl] ester IUPAC Name: [3-[[(2,4-dimethoxyphenyl)carbamoyl-propan-2-ylamino]methyl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-[[(2,4-dimethoxyphenyl)carbamoyl-isopropyl-amino]methyl]phenyl] ester Formula: C20H26N2O6S MolecularWeight: 422.49524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)NC2=C(C=C(C=C2)OC)OC

Isomeric SMILES

CC(C)N(CC1=CC(=CC=C1)OS(=O)(=O)C)C(=O)NC2=C(C=C(C=C2)OC)OC

InChI

InChI=1S/C20H26N2O6S/c1-14(2)22(13-15-7-6-8-17(11-15)28-29(5,24)25)20(23)21-18-10-9-16(26-3)12-19(18)27-4/h6-12,14H,13H2,1-5H3,(H,21,23)