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

Systemtic Name: [5-chloranyl-2-(5-methyl-1,3-benzoxazol-2-yl)phenyl] ethanesulfonate Openeye Name: [5-chloro-2-(5-methyl-1,3-benzoxazol-2-yl)phenyl] ethanesulfonate CAS Name: ethanesulfonic acid [5-chloro-2-(5-methyl-1,3-benzoxazol-2-yl)phenyl] ester IUPAC Name: [5-chloro-2-(5-methyl-1,3-benzoxazol-2-yl)phenyl] ethanesulfonate Traditional Name: ethanesulfonic acid [5-chloro-2-(5-methyl-1,3-benzoxazol-2-yl)phenyl] ester Formula: C16H14ClNO4S MolecularWeight: 351.80466

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)OC1=C(C=CC(=C1)Cl)C2=NC3=C(O2)C=CC(=C3)C

Isomeric SMILES

CCS(=O)(=O)OC1=C(C=CC(=C1)Cl)C2=NC3=C(O2)C=CC(=C3)C

InChI

InChI=1S/C16H14ClNO4S/c1-3-23(19,20)22-15-9-11(17)5-6-12(15)16-18-13-8-10(2)4-7-14(13)21-16/h4-9H,3H2,1-2H3