4-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1-[(2-phenyl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-4-ol

Systemtic Name: 4-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1-[(2-phenyl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-4-ol Openeye Name: 4-[(3-phenylisoxazol-5-yl)methyl]-1-[(2-phenylthiazol-5-yl)methyl]piperidin-1-ium-4-ol CAS Name: 4-[(3-phenyl-5-isoxazolyl)methyl]-1-[(2-phenyl-5-thiazolyl)methyl]-4-piperidin-1-iumol IUPAC Name: 4-[(3-phenyl-1,2-oxazol-5-yl)methyl]-1-[(2-phenyl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-4-ol Traditional Name: 4-[(3-phenylisoxazol-5-yl)methyl]-1-[(2-phenylthiazol-5-yl)methyl]piperidin-1-ium-4-ol Formula: C25H26N3O2S+ MolecularWeight: 432.55784

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1(CC2=CC(=NO2)C3=CC=CC=C3)O)CC4=CN=C(S4)C5=CC=CC=C5

Isomeric SMILES

C1C[NH+](CCC1(CC2=CC(=NO2)C3=CC=CC=C3)O)CC4=CN=C(S4)C5=CC=CC=C5

InChI

InChI=1S/C25H25N3O2S/c29-25(16-21-15-23(27-30-21)19-7-3-1-4-8-19)11-13-28(14-12-25)18-22-17-26-24(31-22)20-9-5-2-6-10-20/h1-10,15,17,29H,11-14,16,18H2/p+1