N-methyl-N-(oxan-4-yl)-2-[(2R)-3-oxidanylidene-1-[(3-phenoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanamide

Systemtic Name: N-methyl-N-(oxan-4-yl)-2-[(2R)-3-oxidanylidene-1-[(3-phenoxyphenyl)methyl]piperazin-1-ium-2-yl]ethanamide Openeye Name: N-methyl-2-[(2R)-3-oxo-1-[(3-phenoxyphenyl)methyl]piperazin-1-ium-2-yl]-N-tetrahydropyran-4-yl-acetamide CAS Name: N-methyl-N-(4-oxanyl)-2-[(2R)-3-oxo-1-[(3-phenoxyphenyl)methyl]-2-piperazin-1-iumyl]acetamide IUPAC Name: N-methyl-N-(oxan-4-yl)-2-[(2R)-3-oxo-1-[(3-phenoxyphenyl)methyl]piperazin-1-ium-2-yl]acetamide Traditional Name: 2-[(2R)-3-keto-1-(3-phenoxybenzyl)piperazin-1-ium-2-yl]-N-methyl-N-tetrahydropyran-4-yl-acetamide Formula: C25H32N3O4+ MolecularWeight: 438.53928

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCOCC1)C(=O)CC2C(=O)NCC[NH+]2CC3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CN(C1CCOCC1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H31N3O4/c1-27(20-10-14-31-15-11-20)24(29)17-23-25(30)26-12-13-28(23)18-19-6-5-9-22(16-19)32-21-7-3-2-4-8-21/h2-9,16,20,23H,10-15,17-18H2,1H3,(H,26,30)/p+1/t23-/m1/s1