[3-[(2-methoxyphenyl)methyl]-1,2-benzoxazol-6-yl] benzenesulfonate

Systemtic Name: [3-[(2-methoxyphenyl)methyl]-1,2-benzoxazol-6-yl] benzenesulfonate Openeye Name: [3-[(2-methoxyphenyl)methyl]-1,2-benzoxazol-6-yl] benzenesulfonate CAS Name: benzenesulfonic acid [3-[(2-methoxyphenyl)methyl]-1,2-benzoxazol-6-yl] ester IUPAC Name: [3-[(2-methoxyphenyl)methyl]-1,2-benzoxazol-6-yl] benzenesulfonate Traditional Name: benzenesulfonic acid (3-o-anisylindoxazen-6-yl) ester Formula: C21H17NO5S MolecularWeight: 395.42838

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CC2=NOC3=C2C=CC(=C3)OS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1CC2=NOC3=C2C=CC(=C3)OS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H17NO5S/c1-25-20-10-6-5-7-15(20)13-19-18-12-11-16(14-21(18)26-22-19)27-28(23,24)17-8-3-2-4-9-17/h2-12,14H,13H2,1H3