1-(1,3-benzoxazol-2-yl)ethyl 4-methylbenzenesulfonate

Systemtic Name: 1-(1,3-benzoxazol-2-yl)ethyl 4-methylbenzenesulfonate Openeye Name: 1-(1,3-benzoxazol-2-yl)ethyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid 1-(1,3-benzoxazol-2-yl)ethyl ester IUPAC Name: 1-(1,3-benzoxazol-2-yl)ethyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid 1-(1,3-benzoxazol-2-yl)ethyl ester Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C2=NC3=CC=CC=C3O2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OC(C)C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C16H15NO4S/c1-11-7-9-13(10-8-11)22(18,19)21-12(2)16-17-14-5-3-4-6-15(14)20-16/h3-10,12H,1-2H3