N-cyclopentyl-2-[4-oxidanylidene-6-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]pyran-3-yl]oxy-ethanamide

Systemtic Name: N-cyclopentyl-2-[4-oxidanylidene-6-[[4-(phenylmethyl)piperazine-1,4-diium-1-yl]methyl]pyran-3-yl]oxy-ethanamide Openeye Name: 2-[6-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-4-oxo-pyran-3-yl]oxy-N-cyclopentyl-acetamide CAS Name: N-cyclopentyl-2-[[4-oxo-6-[[4-(phenylmethyl)-1-piperazine-1,4-diiumyl]methyl]-3-pyranyl]oxy]acetamide IUPAC Name: 2-[6-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-4-oxopyran-3-yl]oxy-N-cyclopentylacetamide Traditional Name: 2-[6-[(4-benzylpiperazine-1,4-diium-1-yl)methyl]-4-keto-pyran-3-yl]oxy-N-cyclopentyl-acetamide Formula: C24H33N3O4+2 MolecularWeight: 427.53652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)NC(=O)COC2=COC(=CC2=O)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4

Isomeric SMILES

C1CCC(C1)NC(=O)COC2=COC(=CC2=O)C[NH+]3CC[NH+](CC3)CC4=CC=CC=C4

InChI

InChI=1S/C24H31N3O4/c28-22-14-21(30-17-23(22)31-18-24(29)25-20-8-4-5-9-20)16-27-12-10-26(11-13-27)15-19-6-2-1-3-7-19/h1-3,6-7,14,17,20H,4-5,8-13,15-16,18H2,(H,25,29)/p+2