[4-[(4-fluorophenyl)sulfonyl-methyl-amino]phenyl] 2-(1,2-benzoxazol-3-yl)ethanoate

Systemtic Name: [4-[(4-fluorophenyl)sulfonyl-methyl-amino]phenyl] 2-(1,2-benzoxazol-3-yl)ethanoate Openeye Name: [4-[(4-fluorophenyl)sulfonyl-methyl-amino]phenyl] 2-(1,2-benzoxazol-3-yl)acetate CAS Name: 2-(1,2-benzoxazol-3-yl)acetic acid [4-[(4-fluorophenyl)sulfonyl-methylamino]phenyl] ester IUPAC Name: [4-[(4-fluorophenyl)sulfonyl-methylamino]phenyl] 2-(1,2-benzoxazol-3-yl)acetate Traditional Name: 2-indoxazen-3-ylacetic acid [4-[(4-fluorophenyl)sulfonyl-methyl-amino]phenyl] ester Formula: C22H17FN2O5S MolecularWeight: 440.444183

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=C(C=C1)OC(=O)CC2=NOC3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CN(C1=CC=C(C=C1)OC(=O)CC2=NOC3=CC=CC=C32)S(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H17FN2O5S/c1-25(31(27,28)18-12-6-15(23)7-13-18)16-8-10-17(11-9-16)29-22(26)14-20-19-4-2-3-5-21(19)30-24-20/h2-13H,14H2,1H3