[4-methoxy-4-oxidanylidene-1-[4-(2H-1,2,3,4-tetrazol-5-yl)phenyl]butan-2-yl]azanium

Systemtic Name: [4-methoxy-4-oxidanylidene-1-[4-(2H-1,2,3,4-tetrazol-5-yl)phenyl]butan-2-yl]azanium Openeye Name: [3-methoxy-3-oxo-1-[[4-(2H-tetrazol-5-yl)phenyl]methyl]propyl]ammonium CAS Name: [4-methoxy-4-oxo-1-[4-(2H-tetrazol-5-yl)phenyl]butan-2-yl]ammonium IUPAC Name: [4-methoxy-4-oxo-1-[4-(2H-tetrazol-5-yl)phenyl]butan-2-yl]azanium Traditional Name: [3-keto-3-methoxy-1-[4-(2H-tetrazol-5-yl)benzyl]propyl]ammonium Formula: C12H16N5O2+ MolecularWeight: 262.28774

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC1=CC=C(C=C1)C2=NNN=N2)[NH3+]

Isomeric SMILES

COC(=O)CC(CC1=CC=C(C=C1)C2=NNN=N2)[NH3+]

InChI

InChI=1S/C12H15N5O2/c1-19-11(18)7-10(13)6-8-2-4-9(5-3-8)12-14-16-17-15-12/h2-5,10H,6-7,13H2,1H3,(H,14,15,16,17)/p+1