2-(3-aminocarbonyl-4-oxidanyl-phenyl)ethyl 4-methylbenzenesulfonate

Systemtic Name: 2-(3-aminocarbonyl-4-oxidanyl-phenyl)ethyl 4-methylbenzenesulfonate Openeye Name: 2-(3-carbamoyl-4-hydroxy-phenyl)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 2-(3-carbamoyl-4-hydroxyphenyl)ethyl ester IUPAC Name: 2-(3-carbamoyl-4-hydroxyphenyl)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 2-(3-carbamoyl-4-hydroxy-phenyl)ethyl ester Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC(=C(C=C2)O)C(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCCC2=CC(=C(C=C2)O)C(=O)N

InChI

InChI=1S/C16H17NO5S/c1-11-2-5-13(6-3-11)23(20,21)22-9-8-12-4-7-15(18)14(10-12)16(17)19/h2-7,10,18H,8-9H2,1H3,(H2,17,19)