[2-(4-methylphenoxy)ethylamino] 4-methylbenzenesulfonate

Systemtic Name: [2-(4-methylphenoxy)ethylamino] 4-methylbenzenesulfonate Openeye Name: [2-(4-methylphenoxy)ethylamino] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [2-(4-methylphenoxy)ethylamino] ester IUPAC Name: [2-(4-methylphenoxy)ethylamino] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [2-(4-methylphenoxy)ethylamino] ester Formula: C16H19NO4S MolecularWeight: 321.39136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCCNOS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CC1=CC=C(C=C1)OCCNOS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C16H19NO4S/c1-13-3-7-15(8-4-13)20-12-11-17-21-22(18,19)16-9-5-14(2)6-10-16/h3-10,17H,11-12H2,1-2H3