[4-[[2-methoxyethyl-[(3-methylphenyl)carbamoyl]amino]methyl]phenyl] ethanesulfonate

Systemtic Name: [4-[[2-methoxyethyl-[(3-methylphenyl)carbamoyl]amino]methyl]phenyl] ethanesulfonate Openeye Name: [4-[[2-methoxyethyl(m-tolylcarbamoyl)amino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [4-[[2-methoxyethyl-[(3-methylanilino)-oxomethyl]amino]methyl]phenyl] ester IUPAC Name: [4-[[2-methoxyethyl-[(3-methylphenyl)carbamoyl]amino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [4-[[2-methoxyethyl(m-tolylcarbamoyl)amino]methyl]phenyl] ester Formula: C20H26N2O5S MolecularWeight: 406.49584

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=CC=C(C=C1)CN(CCOC)C(=O)NC2=CC=CC(=C2)C

Isomeric SMILES

CCS(=O)(=O)OC1=CC=C(C=C1)CN(CCOC)C(=O)NC2=CC=CC(=C2)C

InChI

InChI=1S/C20H26N2O5S/c1-4-28(24,25)27-19-10-8-17(9-11-19)15-22(12-13-26-3)20(23)21-18-7-5-6-16(2)14-18/h5-11,14H,4,12-13,15H2,1-3H3,(H,21,23)