[4-[(2-methoxyethylamino)methyl]phenyl] 4-acetamidobenzenesulfonate

Systemtic Name: [4-[(2-methoxyethylamino)methyl]phenyl] 4-acetamidobenzenesulfonate Openeye Name: [4-[(2-methoxyethylamino)methyl]phenyl] 4-acetamidobenzenesulfonate CAS Name: 4-acetamidobenzenesulfonic acid [4-[(2-methoxyethylamino)methyl]phenyl] ester IUPAC Name: [4-[(2-methoxyethylamino)methyl]phenyl] 4-acetamidobenzenesulfonate Traditional Name: 4-acetamidobenzenesulfonic acid [4-[(2-methoxyethylamino)methyl]phenyl] ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CNCCOC

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC=C(C=C2)CNCCOC

InChI

InChI=1S/C18H22N2O5S/c1-14(21)20-16-5-9-18(10-6-16)26(22,23)25-17-7-3-15(4-8-17)13-19-11-12-24-2/h3-10,19H,11-13H2,1-2H3,(H,20,21)