2,6-bis(morpholin-4-ylmethyl)-1-oxidanidyl-5-(phenylmethyl)pyridin-1-ium-3-ol

Systemtic Name: 2,6-bis(morpholin-4-ylmethyl)-1-oxidanidyl-5-(phenylmethyl)pyridin-1-ium-3-ol Openeye Name: 5-benzyl-2,6-bis(morpholinomethyl)-1-oxido-pyridin-1-ium-3-ol CAS Name: 2,6-bis(4-morpholinylmethyl)-1-oxido-5-(phenylmethyl)-3-pyridin-1-iumol IUPAC Name: 5-benzyl-2,6-bis(morpholin-4-ylmethyl)-1-oxidopyridin-1-ium-3-ol Traditional Name: 5-benzyl-2,6-bis(morpholinomethyl)-1-oxido-pyridin-1-ium-3-ol Formula: C22H29N3O4 MolecularWeight: 399.48336

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CC2=C(C=C(C(=[N+]2[O-])CN3CCOCC3)CC4=CC=CC=C4)O

Isomeric SMILES

C1COCCN1CC2=C(C=C(C(=[N+]2[O-])CN3CCOCC3)CC4=CC=CC=C4)O

InChI

InChI=1S/C22H29N3O4/c26-22-15-19(14-18-4-2-1-3-5-18)20(16-23-6-10-28-11-7-23)25(27)21(22)17-24-8-12-29-13-9-24/h1-5,15,26H,6-14,16-17H2