2-[5-methoxy-4-oxidanylidene-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridin-1-yl]-N-[[(2R)-oxolan-2-yl]methyl]ethanamide

Systemtic Name: 2-[5-methoxy-4-oxidanylidene-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridin-1-yl]-N-[[(2R)-oxolan-2-yl]methyl]ethanamide Openeye Name: 2-[5-methoxy-4-oxo-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1-pyridyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide CAS Name: 2-[5-methoxy-4-oxo-2-[(4-phenyl-1-piperazin-1-iumyl)methyl]-1-pyridinyl]-N-[[(2R)-2-oxolanyl]methyl]acetamide IUPAC Name: 2-[5-methoxy-4-oxo-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]pyridin-1-yl]-N-[[(2R)-oxolan-2-yl]methyl]acetamide Traditional Name: 2-[4-keto-5-methoxy-2-[(4-phenylpiperazin-1-ium-1-yl)methyl]-1-pyridyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]acetamide Formula: C24H33N4O4+ MolecularWeight: 441.54322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(C(=CC1=O)C[NH+]2CCN(CC2)C3=CC=CC=C3)CC(=O)NCC4CCCO4

Isomeric SMILES

COC1=CN(C(=CC1=O)C[NH+]2CCN(CC2)C3=CC=CC=C3)CC(=O)NC[C@H]4CCCO4

InChI

InChI=1S/C24H32N4O4/c1-31-23-17-28(18-24(30)25-15-21-8-5-13-32-21)20(14-22(23)29)16-26-9-11-27(12-10-26)19-6-3-2-4-7-19/h2-4,6-7,14,17,21H,5,8-13,15-16,18H2,1H3,(H,25,30)/p+1/t21-/m1/s1