1-(2-indol-1-ylethyl)-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 1-(2-indol-1-ylethyl)-1,2,3-triazole-4-carboxylic acid Openeye Name: 1-(2-indol-1-ylethyl)triazole-4-carboxylic acid CAS Name: 1-[2-(1-indolyl)ethyl]-4-triazolecarboxylic acid IUPAC Name: 1-(2-indol-1-ylethyl)triazole-4-carboxylic acid Traditional Name: 1-(2-indol-1-ylethyl)triazole-4-carboxylic acid Formula: C13H12N4O2 MolecularWeight: 256.25998

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN2CCN3C=C(N=N3)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CN2CCN3C=C(N=N3)C(=O)O

InChI

InChI=1S/C13H12N4O2/c18-13(19)11-9-17(15-14-11)8-7-16-6-5-10-3-1-2-4-12(10)16/h1-6,9H,7-8H2,(H,18,19)