N-(furan-2-ylmethyl)-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: N-(furan-2-ylmethyl)-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-benzyl-N-(2-furylmethyl)acetamide CAS Name: 2-(4-benzoyl-1-piperazin-1-iumyl)-N-(2-furanylmethyl)-N-(phenylmethyl)acetamide IUPAC Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-benzyl-N-(furan-2-ylmethyl)acetamide Traditional Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-N-benzyl-N-(2-furfuryl)acetamide Formula: C25H28N3O3+ MolecularWeight: 418.50812

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N(CC2=CC=CC=C2)CC3=CC=CO3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N(CC2=CC=CC=C2)CC3=CC=CO3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H27N3O3/c29-24(28(19-23-12-7-17-31-23)18-21-8-3-1-4-9-21)20-26-13-15-27(16-14-26)25(30)22-10-5-2-6-11-22/h1-12,17H,13-16,18-20H2/p+1