2-[4-oxidanylidene-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyran-3-yl]oxy-N-[[(2R)-oxolan-2-yl]methyl]ethanamide

Systemtic Name: 2-[4-oxidanylidene-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyran-3-yl]oxy-N-[[(2R)-oxolan-2-yl]methyl]ethanamide Openeye Name: 2-[4-oxo-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyran-3-yl]oxy-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide CAS Name: N-[[(2R)-2-oxolanyl]methyl]-2-[[4-oxo-6-[(4-phenyl-1-piperazin-1-iumyl)methyl]-3-pyranyl]oxy]acetamide IUPAC Name: N-[[(2R)-oxolan-2-yl]methyl]-2-[4-oxo-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyran-3-yl]oxyacetamide Traditional Name: 2-[4-keto-6-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyran-3-yl]oxy-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide Formula: C23H30N3O5+ MolecularWeight: 428.5014

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CNC(=O)COC2=COC(=CC2=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](OC1)CNC(=O)COC2=COC(=CC2=O)C[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C23H29N3O5/c27-21-13-20(15-25-8-10-26(11-9-25)18-5-2-1-3-6-18)30-16-22(21)31-17-23(28)24-14-19-7-4-12-29-19/h1-3,5-6,13,16,19H,4,7-12,14-15,17H2,(H,24,28)/p+1/t19-/m1/s1