[5-(2-chlorophenyl)furan-2-yl]-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone

Systemtic Name: [5-(2-chlorophenyl)furan-2-yl]-[4-(phenylmethyl)piperazin-4-ium-1-yl]methanone Openeye Name: (4-benzylpiperazin-4-ium-1-yl)-[5-(2-chlorophenyl)-2-furyl]methanone CAS Name: [5-(2-chlorophenyl)-2-furanyl]-[4-(phenylmethyl)-1-piperazin-4-iumyl]methanone IUPAC Name: (4-benzylpiperazin-4-ium-1-yl)-[5-(2-chlorophenyl)furan-2-yl]methanone Traditional Name: (4-benzylpiperazin-4-ium-1-yl)-[5-(2-chlorophenyl)-2-furyl]methanone Formula: C22H22ClN2O2+ MolecularWeight: 381.87528

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC=C(O3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=C2)C(=O)C3=CC=C(O3)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H21ClN2O2/c23-19-9-5-4-8-18(19)20-10-11-21(27-20)22(26)25-14-12-24(13-15-25)16-17-6-2-1-3-7-17/h1-11H,12-16H2/p+1