3-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]propyl N-(6-bromanyl-1,3-benzodioxol-5-yl)carbamate

Systemtic Name: 3-[4-(6-fluoranyl-1,2-benzoxazol-3-yl)piperidin-1-yl]propyl N-(6-bromanyl-1,3-benzodioxol-5-yl)carbamate Openeye Name: 3-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidyl]propyl N-(6-bromo-1,3-benzodioxol-5-yl)carbamate CAS Name: N-(6-bromo-1,3-benzodioxol-5-yl)carbamic acid 3-[4-(6-fluoro-1,2-benzoxazol-3-yl)-1-piperidinyl]propyl ester IUPAC Name: 3-[4-(6-fluoro-1,2-benzoxazol-3-yl)piperidin-1-yl]propyl N-(6-bromo-1,3-benzodioxol-5-yl)carbamate Traditional Name: N-(6-bromo-1,3-benzodioxol-5-yl)carbamic acid 3-[4-(6-fluoroindoxazen-3-yl)piperidino]propyl ester Formula: C23H23BrFN3O5 MolecularWeight: 520.348223

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NOC3=C2C=CC(=C3)F)CCCOC(=O)NC4=CC5=C(C=C4Br)OCO5

Isomeric SMILES

C1CN(CCC1C2=NOC3=C2C=CC(=C3)F)CCCOC(=O)NC4=CC5=C(C=C4Br)OCO5

InChI

InChI=1S/C23H23BrFN3O5/c24-17-11-20-21(32-13-31-20)12-18(17)26-23(29)30-9-1-6-28-7-4-14(5-8-28)22-16-3-2-15(25)10-19(16)33-27-22/h2-3,10-12,14H,1,4-9,13H2,(H,26,29)