8-fluoranyl-3-[(E)-(4-octoxyphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one

Systemtic Name: 8-fluoranyl-3-[(E)-(4-octoxyphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one Openeye Name: 8-fluoro-3-[(E)-(4-octoxyphenyl)methyleneamino]-5H-pyrimido[5,4-b]indol-4-one CAS Name: 8-fluoro-3-[(E)-(4-octoxyphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one IUPAC Name: 8-fluoro-3-[(E)-(4-octoxyphenyl)methylideneamino]-5H-pyrimido[5,4-b]indol-4-one Traditional Name: 8-fluoro-3-[(E)-(4-octoxybenzylidene)amino]-5H-pyrimid[5,4-b]indol-4-one Formula: C25H27FN4O2 MolecularWeight: 434.505883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C=NN2C=NC3=C(C2=O)NC4=C3C=C(C=C4)F

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)/C=N/N2C=NC3=C(C2=O)NC4=C3C=C(C=C4)F

InChI

InChI=1S/C25H27FN4O2/c1-2-3-4-5-6-7-14-32-20-11-8-18(9-12-20)16-28-30-17-27-23-21-15-19(26)10-13-22(21)29-24(23)25(30)31/h8-13,15-17,29H,2-7,14H2,1H3/b28-16+