sodium 3-[(4-chlorophenyl)methyl]-5-methoxycarbonyl-1,2,3-triazol-4-olate

Systemtic Name: sodium 3-[(4-chlorophenyl)methyl]-5-methoxycarbonyl-1,2,3-triazol-4-olate Openeye Name: sodium 3-[(4-chlorophenyl)methyl]-5-methoxycarbonyl-triazol-4-olate CAS Name: sodium 3-[(4-chlorophenyl)methyl]-5-methoxycarbonyl-4-triazololate IUPAC Name: sodium 3-[(4-chlorophenyl)methyl]-5-methoxycarbonyltriazol-4-olate Traditional Name: sodium 5-carbomethoxy-3-(4-chlorobenzyl)triazol-4-olate Formula: C11H9ClN3NaO3 MolecularWeight: 289.65023

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(N=N1)CC2=CC=C(C=C2)Cl)[O-].[Na+]

Isomeric SMILES

COC(=O)C1=C(N(N=N1)CC2=CC=C(C=C2)Cl)[O-].[Na+]

InChI

InChI=1S/C11H10ClN3O3.Na/c1-18-11(17)9-10(16)15(14-13-9)6-7-2-4-8(12)5-3-7;/h2-5,16H,6H2,1H3;/q;+1/p-1