1-naphthalen-2-yl-5-(1,2,4-triazol-1-yl)pentan-3-one

Systemtic Name: 1-naphthalen-2-yl-5-(1,2,4-triazol-1-yl)pentan-3-one Openeye Name: 1-(2-naphthyl)-5-(1,2,4-triazol-1-yl)pentan-3-one CAS Name: 1-(2-naphthalenyl)-5-(1,2,4-triazol-1-yl)-3-pentanone IUPAC Name: 1-naphthalen-2-yl-5-(1,2,4-triazol-1-yl)pentan-3-one Traditional Name: 1-(2-naphthyl)-5-(1,2,4-triazol-1-yl)pentan-3-one Formula: C17H17N3O MolecularWeight: 279.33638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CCC(=O)CCN3C=NC=N3

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CCC(=O)CCN3C=NC=N3

InChI

InChI=1S/C17H17N3O/c21-17(9-10-20-13-18-12-19-20)8-6-14-5-7-15-3-1-2-4-16(15)11-14/h1-5,7,11-13H,6,8-10H2