5-methyl-4-(1,2,4-triazol-1-ylmethyl)furan-2-carboxylic acid

Systemtic Name: 5-methyl-4-(1,2,4-triazol-1-ylmethyl)furan-2-carboxylic acid Openeye Name: 5-methyl-4-(1,2,4-triazol-1-ylmethyl)furan-2-carboxylic acid CAS Name: 5-methyl-4-(1,2,4-triazol-1-ylmethyl)-2-furancarboxylic acid IUPAC Name: 5-methyl-4-(1,2,4-triazol-1-ylmethyl)furan-2-carboxylic acid Traditional Name: 5-methyl-4-(1,2,4-triazol-1-ylmethyl)-2-furoic acid Formula: C9H9N3O3 MolecularWeight: 207.18606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)C(=O)O)CN2C=NC=N2

Isomeric SMILES

CC1=C(C=C(O1)C(=O)O)CN2C=NC=N2

InChI

InChI=1S/C9H9N3O3/c1-6-7(2-8(15-6)9(13)14)3-12-5-10-4-11-12/h2,4-5H,3H2,1H3,(H,13,14)