(2-phenoxyethylamino) 4-methylbenzenesulfonate

Systemtic Name: (2-phenoxyethylamino) 4-methylbenzenesulfonate Openeye Name: (2-phenoxyethylamino) 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (2-phenoxyethylamino) ester IUPAC Name: (2-phenoxyethylamino) 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (2-phenoxyethylamino) ester Formula: C15H17NO4S MolecularWeight: 307.36478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)ONCCOC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)ONCCOC2=CC=CC=C2

InChI

InChI=1S/C15H17NO4S/c1-13-7-9-15(10-8-13)21(17,18)20-16-11-12-19-14-5-3-2-4-6-14/h2-10,16H,11-12H2,1H3