6-(azepan-1-ylsulfonyl)-3-[2-(2-fluoranylphenoxy)ethyl]-1,3-benzoxazol-2-one

Systemtic Name: 6-(azepan-1-ylsulfonyl)-3-[2-(2-fluoranylphenoxy)ethyl]-1,3-benzoxazol-2-one Openeye Name: 6-(azepan-1-ylsulfonyl)-3-[2-(2-fluorophenoxy)ethyl]-1,3-benzoxazol-2-one CAS Name: 6-(1-azepanylsulfonyl)-3-[2-(2-fluorophenoxy)ethyl]-1,3-benzoxazol-2-one IUPAC Name: 6-(azepan-1-ylsulfonyl)-3-[2-(2-fluorophenoxy)ethyl]-1,3-benzoxazol-2-one Traditional Name: 6-(azepan-1-ylsulfonyl)-3-[2-(2-fluorophenoxy)ethyl]-1,3-benzoxazol-2-one Formula: C21H23FN2O5S MolecularWeight: 434.481123

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCOC4=CC=CC=C4F

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CCOC4=CC=CC=C4F

InChI

InChI=1S/C21H23FN2O5S/c22-17-7-3-4-8-19(17)28-14-13-24-18-10-9-16(15-20(18)29-21(24)25)30(26,27)23-11-5-1-2-6-12-23/h3-4,7-10,15H,1-2,5-6,11-14H2