N-[4-[5-[2-(3,4-dimethoxyphenyl)ethylamino]pentyl]phenyl]-5-fluoranyl-9-oxidanylidene-10H-acridine-4-carboxamide

Systemtic Name: N-[4-[5-[2-(3,4-dimethoxyphenyl)ethylamino]pentyl]phenyl]-5-fluoranyl-9-oxidanylidene-10H-acridine-4-carboxamide Openeye Name: N-[4-[5-[2-(3,4-dimethoxyphenyl)ethylamino]pentyl]phenyl]-5-fluoro-9-oxo-10H-acridine-4-carboxamide CAS Name: N-[4-[5-[2-(3,4-dimethoxyphenyl)ethylamino]pentyl]phenyl]-5-fluoro-9-oxo-10H-acridine-4-carboxamide IUPAC Name: N-[4-[5-[2-(3,4-dimethoxyphenyl)ethylamino]pentyl]phenyl]-5-fluoro-9-oxo-10H-acridine-4-carboxamide Traditional Name: 5-fluoro-N-[4-[5-(homoveratrylamino)pentyl]phenyl]-9-keto-10H-acridine-4-carboxamide Formula: C35H36FN3O4 MolecularWeight: 581.676443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCCCCCC2=CC=C(C=C2)NC(=O)C3=CC=CC4=C3NC5=C(C4=O)C=CC=C5F)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCCCCCC2=CC=C(C=C2)NC(=O)C3=CC=CC4=C3NC5=C(C4=O)C=CC=C5F)OC

InChI

InChI=1S/C35H36FN3O4/c1-42-30-18-15-24(22-31(30)43-2)19-21-37-20-5-3-4-8-23-13-16-25(17-14-23)38-35(41)28-11-6-9-26-32(28)39-33-27(34(26)40)10-7-12-29(33)36/h6-7,9-18,22,37H,3-5,8,19-21H2,1-2H3,(H,38,41)(H,39,40)