[5-(2-chlorophenyl)furan-2-yl]-[4-(quinolin-8-ylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [5-(2-chlorophenyl)furan-2-yl]-[4-(quinolin-8-ylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: [5-(2-chlorophenyl)-2-furyl]-[4-(8-quinolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: [5-(2-chlorophenyl)-2-furanyl]-[4-(8-quinolinylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: [5-(2-chlorophenyl)furan-2-yl]-[4-(quinolin-8-ylmethyl)piperazin-4-ium-1-yl]methanone Traditional Name: [5-(2-chlorophenyl)-2-furyl]-[4-(8-quinolylmethyl)piperazin-4-ium-1-yl]methanone Formula: C25H23ClN3O2+ MolecularWeight: 432.92202

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC3=C2N=CC=C3)C(=O)C4=CC=C(O4)C5=CC=CC=C5Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC3=C2N=CC=C3)C(=O)C4=CC=C(O4)C5=CC=CC=C5Cl

InChI

InChI=1S/C25H22ClN3O2/c26-21-9-2-1-8-20(21)22-10-11-23(31-22)25(30)29-15-13-28(14-16-29)17-19-6-3-5-18-7-4-12-27-24(18)19/h1-12H,13-17H2/p+1