5-(1,2,4-triazol-1-ylmethyl)-1H-indole-3-carboxylic acid

Systemtic Name: 5-(1,2,4-triazol-1-ylmethyl)-1H-indole-3-carboxylic acid Openeye Name: 5-(1,2,4-triazol-1-ylmethyl)-1H-indole-3-carboxylic acid CAS Name: 5-(1,2,4-triazol-1-ylmethyl)-1H-indole-3-carboxylic acid IUPAC Name: 5-(1,2,4-triazol-1-ylmethyl)-1H-indole-3-carboxylic acid Traditional Name: 5-(1,2,4-triazol-1-ylmethyl)-1H-indole-3-carboxylic acid Formula: C12H10N4O2 MolecularWeight: 242.2334

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1CN3C=NC=N3)C(=CN2)C(=O)O

Isomeric SMILES

C1=CC2=C(C=C1CN3C=NC=N3)C(=CN2)C(=O)O

InChI

InChI=1S/C12H10N4O2/c17-12(18)10-4-14-11-2-1-8(3-9(10)11)5-16-7-13-6-15-16/h1-4,6-7,14H,5H2,(H,17,18)