1-[2-[5-chloranyl-1-(4-fluorophenyl)-3-piperidin-4-yl-indol-1-ium-1-yl]ethyl]-3-decanoyl-imidazolidin-2-one

Systemtic Name: 1-[2-[5-chloranyl-1-(4-fluorophenyl)-3-piperidin-4-yl-indol-1-ium-1-yl]ethyl]-3-decanoyl-imidazolidin-2-one Openeye Name: 1-[2-[5-chloro-1-(4-fluorophenyl)-3-(4-piperidyl)indol-1-ium-1-yl]ethyl]-3-decanoyl-imidazolidin-2-one CAS Name: 1-[2-[5-chloro-1-(4-fluorophenyl)-3-(4-piperidinyl)-1-indol-1-iumyl]ethyl]-3-(1-oxodecyl)-2-imidazolidinone IUPAC Name: 1-[2-[5-chloro-1-(4-fluorophenyl)-3-piperidin-4-ylindol-1-ium-1-yl]ethyl]-3-decanoylimidazolidin-2-one Traditional Name: 1-capryl-3-[2-[5-chloro-1-(4-fluorophenyl)-3-(4-piperidyl)indol-1-ium-1-yl]ethyl]-2-imidazolidinone Formula: C34H45ClFN4O2+ MolecularWeight: 596.198103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)N1CCN(C1=O)CC[N+]2(C=C(C3=C2C=CC(=C3)Cl)C4CCNCC4)C5=CC=C(C=C5)F

Isomeric SMILES

CCCCCCCCCC(=O)N1CCN(C1=O)CC[N+]2(C=C(C3=C2C=CC(=C3)Cl)C4CCNCC4)C5=CC=C(C=C5)F

InChI

InChI=1S/C34H45ClFN4O2/c1-2-3-4-5-6-7-8-9-33(41)39-21-20-38(34(39)42)22-23-40(29-13-11-28(36)12-14-29)25-31(26-16-18-37-19-17-26)30-24-27(35)10-15-32(30)40/h10-15,24-26,37H,2-9,16-23H2,1H3/q+1