[4-[[ethanoyl(propan-2-yl)amino]methyl]phenyl] ethanesulfonate

Systemtic Name: [4-[[ethanoyl(propan-2-yl)amino]methyl]phenyl] ethanesulfonate Openeye Name: [4-[[acetyl(isopropyl)amino]methyl]phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [4-[[acetyl(propan-2-yl)amino]methyl]phenyl] ester IUPAC Name: [4-[[acetyl(propan-2-yl)amino]methyl]phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [4-[[acetyl(isopropyl)amino]methyl]phenyl] ester Formula: C14H21NO4S MolecularWeight: 299.38584

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21NO4S/c1-5-20(17,18)19-14-8-6-13(7-9-14)10-15(11(2)3)12(4)16/h6-9,11H,5,10H2,1-4H3