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

Systemtic Name: (5E)-3-methoxy-5-[1-nitroso-2-[4-(phenylmethyl)piperidin-1-yl]propylidene]-2H-1,2-oxazole Openeye Name: (5E)-5-[2-(4-benzyl-1-piperidyl)-1-nitroso-propylidene]-3-methoxy-2H-isoxazole CAS Name: (5E)-3-methoxy-5-[1-nitroso-2-[4-(phenylmethyl)-1-piperidinyl]propylidene]-2H-isoxazole IUPAC Name: (5E)-5-[2-(4-benzylpiperidin-1-yl)-1-nitrosopropylidene]-3-methoxy-2H-1,2-oxazole Traditional Name: (5E)-5-[2-(4-benzylpiperidino)-1-nitroso-propylidene]-3-methoxy-3-isoxazoline Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=C1C=C(NO1)OC)N=O)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(/C(=C\1/C=C(NO1)OC)/N=O)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C19H25N3O3/c1-14(19(20-23)17-13-18(24-2)21-25-17)22-10-8-16(9-11-22)12-15-6-4-3-5-7-15/h3-7,13-14,16,21H,8-12H2,1-2H3/b19-17+