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

Systemtic Name: 1-[[4-(2-hydroxyethyloxy)phenyl]methyl]-4-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidin-1-ium-4-ol Openeye Name: 1-[[4-(2-hydroxyethoxy)phenyl]methyl]-4-[(3-phenylisoxazol-5-yl)methyl]piperidin-1-ium-4-ol CAS Name: 1-[[4-(2-hydroxyethoxy)phenyl]methyl]-4-[(3-phenyl-5-isoxazolyl)methyl]-4-piperidin-1-iumol IUPAC Name: 1-[[4-(2-hydroxyethoxy)phenyl]methyl]-4-[(3-phenyl-1,2-oxazol-5-yl)methyl]piperidin-1-ium-4-ol Traditional Name: 1-[4-(2-hydroxyethoxy)benzyl]-4-[(3-phenylisoxazol-5-yl)methyl]piperidin-1-ium-4-ol Formula: C24H29N2O4+ MolecularWeight: 409.49806

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1(CC2=CC(=NO2)C3=CC=CC=C3)O)CC4=CC=C(C=C4)OCCO

Isomeric SMILES

C1C[NH+](CCC1(CC2=CC(=NO2)C3=CC=CC=C3)O)CC4=CC=C(C=C4)OCCO

InChI

InChI=1S/C24H28N2O4/c27-14-15-29-21-8-6-19(7-9-21)18-26-12-10-24(28,11-13-26)17-22-16-23(25-30-22)20-4-2-1-3-5-20/h1-9,16,27-28H,10-15,17-18H2/p+1