(5E)-3-methoxy-5-[1-nitroso-2-[4-(phenylmethyl)piperidin-1-yl]ethylidene]-2H-1,2-oxazole

Systemtic Name: (5E)-3-methoxy-5-[1-nitroso-2-[4-(phenylmethyl)piperidin-1-yl]ethylidene]-2H-1,2-oxazole Openeye Name: (5E)-5-[2-(4-benzyl-1-piperidyl)-1-nitroso-ethylidene]-3-methoxy-2H-isoxazole CAS Name: (5E)-3-methoxy-5-[1-nitroso-2-[4-(phenylmethyl)-1-piperidinyl]ethylidene]-2H-isoxazole IUPAC Name: (5E)-5-[2-(4-benzylpiperidin-1-yl)-1-nitrosoethylidene]-3-methoxy-2H-1,2-oxazole Traditional Name: (5E)-5-[2-(4-benzylpiperidino)-1-nitroso-ethylidene]-3-methoxy-3-isoxazoline Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(CN2CCC(CC2)CC3=CC=CC=C3)N=O)ON1

Isomeric SMILES

COC1=C/C(=C(/CN2CCC(CC2)CC3=CC=CC=C3)\N=O)/ON1

InChI

InChI=1S/C18H23N3O3/c1-23-18-12-17(24-20-18)16(19-22)13-21-9-7-15(8-10-21)11-14-5-3-2-4-6-14/h2-6,12,15,20H,7-11,13H2,1H3/b17-16+