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

Systemtic Name: 1-[2-[5-chloranyl-1-(4-fluorophenyl)-3-piperidin-4-yl-indol-1-ium-1-yl]ethyl]-3-hexanoyl-imidazolidin-2-one Openeye Name: 1-[2-[5-chloro-1-(4-fluorophenyl)-3-(4-piperidyl)indol-1-ium-1-yl]ethyl]-3-hexanoyl-imidazolidin-2-one CAS Name: 1-[2-[5-chloro-1-(4-fluorophenyl)-3-(4-piperidinyl)-1-indol-1-iumyl]ethyl]-3-(1-oxohexyl)-2-imidazolidinone IUPAC Name: 1-[2-[5-chloro-1-(4-fluorophenyl)-3-piperidin-4-ylindol-1-ium-1-yl]ethyl]-3-hexanoylimidazolidin-2-one Traditional Name: 1-caproyl-3-[2-[5-chloro-1-(4-fluorophenyl)-3-(4-piperidyl)indol-1-ium-1-yl]ethyl]-2-imidazolidinone Formula: C30H37ClFN4O2+ MolecularWeight: 540.091783

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H37ClFN4O2/c1-2-3-4-5-29(37)35-17-16-34(30(35)38)18-19-36(25-9-7-24(32)8-10-25)21-27(22-12-14-33-15-13-22)26-20-23(31)6-11-28(26)36/h6-11,20-22,33H,2-5,12-19H2,1H3/q+1