[3-[(4-chlorophenyl)methyl]-1,2-benzoxazol-6-yl] methanesulfonate

Systemtic Name: [3-[(4-chlorophenyl)methyl]-1,2-benzoxazol-6-yl] methanesulfonate Openeye Name: [3-[(4-chlorophenyl)methyl]-1,2-benzoxazol-6-yl] methanesulfonate CAS Name: methanesulfonic acid [3-[(4-chlorophenyl)methyl]-1,2-benzoxazol-6-yl] ester IUPAC Name: [3-[(4-chlorophenyl)methyl]-1,2-benzoxazol-6-yl] methanesulfonate Traditional Name: methanesulfonic acid [3-(4-chlorobenzyl)indoxazen-6-yl] ester Formula: C15H12ClNO4S MolecularWeight: 337.77808

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)OC1=CC2=C(C=C1)C(=NO2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CS(=O)(=O)OC1=CC2=C(C=C1)C(=NO2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C15H12ClNO4S/c1-22(18,19)21-12-6-7-13-14(17-20-15(13)9-12)8-10-2-4-11(16)5-3-10/h2-7,9H,8H2,1H3