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

Systemtic Name: N-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]propyl]-2-methoxy-phenyl]-5-fluoranyl-9-oxidanylidene-10H-acridine-4-carboxamide Openeye Name: N-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]propyl]-2-methoxy-phenyl]-5-fluoro-9-oxo-10H-acridine-4-carboxamide CAS Name: N-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]propyl]-2-methoxyphenyl]-5-fluoro-9-oxo-10H-acridine-4-carboxamide IUPAC Name: N-[4-[3-[2-(3,4-dimethoxyphenyl)ethylamino]propyl]-2-methoxyphenyl]-5-fluoro-9-oxo-10H-acridine-4-carboxamide Traditional Name: 5-fluoro-N-[4-[3-(homoveratrylamino)propyl]-2-methoxy-phenyl]-9-keto-10H-acridine-4-carboxamide Formula: C34H34FN3O5 MolecularWeight: 583.649263

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNCCCC2=CC(=C(C=C2)NC(=O)C3=CC=CC4=C3NC5=C(C4=O)C=CC=C5F)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNCCCC2=CC(=C(C=C2)NC(=O)C3=CC=CC4=C3NC5=C(C4=O)C=CC=C5F)OC)OC

InChI

InChI=1S/C34H34FN3O5/c1-41-28-15-13-22(20-30(28)43-3)16-18-36-17-6-7-21-12-14-27(29(19-21)42-2)37-34(40)25-10-4-8-23-31(25)38-32-24(33(23)39)9-5-11-26(32)35/h4-5,8-15,19-20,36H,6-7,16-18H2,1-3H3,(H,37,40)(H,38,39)