[2-[2-[5-(1H-benzimidazol-2-yl)pentyl-dodecyl-amino]ethyl]-6-fluoranyl-1-propan-2-yl-3,4-dihydro-1H-naphthalen-2-yl] 2-methoxyethanoate

Systemtic Name: [2-[2-[5-(1H-benzimidazol-2-yl)pentyl-dodecyl-amino]ethyl]-6-fluoranyl-1-propan-2-yl-3,4-dihydro-1H-naphthalen-2-yl] 2-methoxyethanoate Openeye Name: [2-[2-[5-(1H-benzimidazol-2-yl)pentyl-dodecyl-amino]ethyl]-6-fluoro-1-isopropyl-tetralin-2-yl] 2-methoxyacetate CAS Name: 2-methoxyacetic acid [2-[2-[5-(1H-benzimidazol-2-yl)pentyl-dodecylamino]ethyl]-6-fluoro-1-propan-2-yl-3,4-dihydro-1H-naphthalen-2-yl] ester IUPAC Name: [2-[2-[5-(1H-benzimidazol-2-yl)pentyl-dodecylamino]ethyl]-6-fluoro-1-propan-2-yl-3,4-dihydro-1H-naphthalen-2-yl] 2-methoxyacetate Traditional Name: 2-methoxyacetic acid [2-[2-[5-(1H-benzimidazol-2-yl)pentyl-lauryl-amino]ethyl]-6-fluoro-1-isopropyl-tetralin-2-yl] ester Formula: C42H64FN3O3 MolecularWeight: 677.974263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN(CCCCCC1=NC2=CC=CC=C2N1)CCC3(CCC4=C(C3C(C)C)C=CC(=C4)F)OC(=O)COC

Isomeric SMILES

CCCCCCCCCCCCN(CCCCCC1=NC2=CC=CC=C2N1)CCC3(CCC4=C(C3C(C)C)C=CC(=C4)F)OC(=O)COC

InChI

InChI=1S/C42H64FN3O3/c1-5-6-7-8-9-10-11-12-13-18-28-46(29-19-14-15-22-39-44-37-20-16-17-21-38(37)45-39)30-27-42(49-40(47)32-48-4)26-25-34-31-35(43)23-24-36(34)41(42)33(2)3/h16-17,20-21,23-24,31,33,41H,5-15,18-19,22,25-30,32H2,1-4H3,(H,44,45)