[4-(2-methyl-1-morpholin-4-ium-4-ylidene-propan-2-yl)-3a,4-dihydrobenzotriazol-5-ylidene]-bis(oxidanidyl)azanium

Systemtic Name: [4-(2-methyl-1-morpholin-4-ium-4-ylidene-propan-2-yl)-3a,4-dihydrobenzotriazol-5-ylidene]-bis(oxidanidyl)azanium Openeye Name: [4-(1,1-dimethyl-2-morpholin-4-ium-4-ylidene-ethyl)-3a,4-dihydrobenzotriazol-5-ylidene]-dioxido-ammonium CAS Name: [4-[2-methyl-1-(4-morpholin-4-iumylidene)propan-2-yl]-3a,4-dihydrobenzotriazol-5-ylidene]-dioxidoammonium IUPAC Name: [4-(2-methyl-1-morpholin-4-ium-4-ylidenepropan-2-yl)-3a,4-dihydrobenzotriazol-5-ylidene]-dioxidoazanium Traditional Name: [4-(1,1-dimethyl-2-morpholin-4-ium-4-ylidene-ethyl)-3a,4-dihydrobenzotriazol-5-ylidene]-dioxido-ammonium Formula: C14H19N5O3 MolecularWeight: 305.33236

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=[N+]1CCOCC1)C2C3C(=NN=N3)C=CC2=[N+]([O-])[O-]

Isomeric SMILES

CC(C1/C(=[N+](\[O-])/[O-])/C=CC2=NN=NC12)(C=[N+]3CCOCC3)C

InChI

InChI=1S/C14H19N5O3/c1-14(2,9-18-5-7-22-8-6-18)12-11(19(20)21)4-3-10-13(12)16-17-15-10/h3-4,9,12-13H,5-8H2,1-2H3