[2-methoxy-5-[[phenylcarbonyl(propan-2-yl)amino]methyl]phenyl] ethanesulfonate

Systemtic Name: [2-methoxy-5-[[phenylcarbonyl(propan-2-yl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [5-[[benzoyl(isopropyl)amino]methyl]-2-methoxy-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [5-[[benzoyl(propan-2-yl)amino]methyl]-2-methoxyphenyl] ester IUPAC Name: [5-[[benzoyl(propan-2-yl)amino]methyl]-2-methoxyphenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-[[benzoyl(isopropyl)amino]methyl]-2-methoxy-phenyl] ester Formula: C20H25NO5S MolecularWeight: 391.4812

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=C(C=CC(=C1)CN(C(C)C)C(=O)C2=CC=CC=C2)OC

Isomeric SMILES

CCS(=O)(=O)OC1=C(C=CC(=C1)CN(C(C)C)C(=O)C2=CC=CC=C2)OC

InChI

InChI=1S/C20H25NO5S/c1-5-27(23,24)26-19-13-16(11-12-18(19)25-4)14-21(15(2)3)20(22)17-9-7-6-8-10-17/h6-13,15H,5,14H2,1-4H3