1-[2-(1,2,4-triazol-1-yl)propanoyl]-2,3-dihydroindole-5-carboxylic acid

Systemtic Name: 1-[2-(1,2,4-triazol-1-yl)propanoyl]-2,3-dihydroindole-5-carboxylic acid Openeye Name: 1-[2-(1,2,4-triazol-1-yl)propanoyl]indoline-5-carboxylic acid CAS Name: 1-[1-oxo-2-(1,2,4-triazol-1-yl)propyl]-2,3-dihydroindole-5-carboxylic acid IUPAC Name: 1-[2-(1,2,4-triazol-1-yl)propanoyl]-2,3-dihydroindole-5-carboxylic acid Traditional Name: 1-[2-(1,2,4-triazol-1-yl)propanoyl]indoline-5-carboxylic acid Formula: C14H14N4O3 MolecularWeight: 286.28596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCC2=C1C=CC(=C2)C(=O)O)N3C=NC=N3

Isomeric SMILES

CC(C(=O)N1CCC2=C1C=CC(=C2)C(=O)O)N3C=NC=N3

InChI

InChI=1S/C14H14N4O3/c1-9(18-8-15-7-16-18)13(19)17-5-4-10-6-11(14(20)21)2-3-12(10)17/h2-3,6-9H,4-5H2,1H3,(H,20,21)