3-(1,3-benzodioxol-5-ylmethyl)-8-fluoranyl-5-methyl-pyrimido[5,4-b]indol-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-8-fluoranyl-5-methyl-pyrimido[5,4-b]indol-4-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-8-fluoro-5-methyl-pyrimido[5,4-b]indol-4-one CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-8-fluoro-5-methyl-4-pyrimido[5,4-b]indolone IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-8-fluoro-5-methylpyrimido[5,4-b]indol-4-one Traditional Name: 8-fluoro-5-methyl-3-piperonyl-pyrimid[5,4-b]indol-4-one Formula: C19H14FN3O3 MolecularWeight: 351.331163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=C(C=C2)F)C3=C1C(=O)N(C=N3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C2=C(C=C(C=C2)F)C3=C1C(=O)N(C=N3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C19H14FN3O3/c1-22-14-4-3-12(20)7-13(14)17-18(22)19(24)23(9-21-17)8-11-2-5-15-16(6-11)26-10-25-15/h2-7,9H,8,10H2,1H3