[1-methoxy-3-[4-(4-methoxycarbonyl-1,2,3-triazol-1-yl)phenyl]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [1-methoxy-3-[4-(4-methoxycarbonyl-1,2,3-triazol-1-yl)phenyl]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [2-methoxy-1-[[4-(4-methoxycarbonyltriazol-1-yl)phenyl]methyl]-2-oxo-ethyl]ammonium CAS Name: [1-methoxy-3-[4-(4-methoxycarbonyl-1-triazolyl)phenyl]-1-oxopropan-2-yl]ammonium IUPAC Name: [1-methoxy-3-[4-(4-methoxycarbonyltriazol-1-yl)phenyl]-1-oxopropan-2-yl]azanium Traditional Name: [1-[4-(4-carbomethoxytriazol-1-yl)benzyl]-2-keto-2-methoxy-ethyl]ammonium Formula: C14H17N4O4+ MolecularWeight: 305.30918

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN(N=N1)C2=CC=C(C=C2)CC(C(=O)OC)[NH3+]

Isomeric SMILES

COC(=O)C1=CN(N=N1)C2=CC=C(C=C2)CC(C(=O)OC)[NH3+]

InChI

InChI=1S/C14H16N4O4/c1-21-13(19)11(15)7-9-3-5-10(6-4-9)18-8-12(16-17-18)14(20)22-2/h3-6,8,11H,7,15H2,1-2H3/p+1