3-[4-[3-(azepan-1-yl)propoxy]phenyl]-6-fluoranyl-1,2-benzoxazole

Systemtic Name: 3-[4-[3-(azepan-1-yl)propoxy]phenyl]-6-fluoranyl-1,2-benzoxazole Openeye Name: 3-[4-[3-(azepan-1-yl)propoxy]phenyl]-6-fluoro-1,2-benzoxazole CAS Name: 3-[4-[3-(1-azepanyl)propoxy]phenyl]-6-fluoro-1,2-benzoxazole IUPAC Name: 3-[4-[3-(azepan-1-yl)propoxy]phenyl]-6-fluoro-1,2-benzoxazole Traditional Name: 3-[4-[3-(azepan-1-yl)propoxy]phenyl]-6-fluoro-indoxazene Formula: C22H25FN2O2 MolecularWeight: 368.444503

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCOC2=CC=C(C=C2)C3=NOC4=C3C=CC(=C4)F

Isomeric SMILES

C1CCCN(CC1)CCCOC2=CC=C(C=C2)C3=NOC4=C3C=CC(=C4)F

InChI

InChI=1S/C22H25FN2O2/c23-18-8-11-20-21(16-18)27-24-22(20)17-6-9-19(10-7-17)26-15-5-14-25-12-3-1-2-4-13-25/h6-11,16H,1-5,12-15H2