[2-(1,3-benzoxazol-2-yl)-5-chloranyl-phenyl] ethanesulfonate

Systemtic Name: [2-(1,3-benzoxazol-2-yl)-5-chloranyl-phenyl] ethanesulfonate Openeye Name: [2-(1,3-benzoxazol-2-yl)-5-chloro-phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [2-(1,3-benzoxazol-2-yl)-5-chlorophenyl] ester IUPAC Name: [2-(1,3-benzoxazol-2-yl)-5-chlorophenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [2-(1,3-benzoxazol-2-yl)-5-chloro-phenyl] ester Formula: C15H12ClNO4S MolecularWeight: 337.77808

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=C(C=CC(=C1)Cl)C2=NC3=CC=CC=C3O2

Isomeric SMILES

CCS(=O)(=O)OC1=C(C=CC(=C1)Cl)C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C15H12ClNO4S/c1-2-22(18,19)21-14-9-10(16)7-8-11(14)15-17-12-5-3-4-6-13(12)20-15/h3-9H,2H2,1H3