5-(1H-1,2,4-triazol-5-ylmethyl)-2,3-dihydroinden-1-one

Systemtic Name: 5-(1H-1,2,4-triazol-5-ylmethyl)-2,3-dihydroinden-1-one Openeye Name: 5-(1H-1,2,4-triazol-5-ylmethyl)indan-1-one CAS Name: 5-(1H-1,2,4-triazol-5-ylmethyl)-2,3-dihydroinden-1-one IUPAC Name: 5-(1H-1,2,4-triazol-5-ylmethyl)-2,3-dihydroinden-1-one Traditional Name: 5-(1H-1,2,4-triazol-5-ylmethyl)indan-1-one Formula: C12H11N3O MolecularWeight: 213.23524

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2=C1C=C(C=C2)CC3=NC=NN3

Isomeric SMILES

C1CC(=O)C2=C1C=C(C=C2)CC3=NC=NN3

InChI

InChI=1S/C12H11N3O/c16-11-4-2-9-5-8(1-3-10(9)11)6-12-13-7-14-15-12/h1,3,5,7H,2,4,6H2,(H,13,14,15)