4-(2-methylprop-2-enyl)-2-(phenylmethyl)-1H-1,2,3-triazol-5-one

Systemtic Name: 4-(2-methylprop-2-enyl)-2-(phenylmethyl)-1H-1,2,3-triazol-5-one Openeye Name: 2-benzyl-4-(2-methylallyl)-1H-triazol-5-one CAS Name: 4-(2-methylprop-2-enyl)-2-(phenylmethyl)-1H-triazol-5-one IUPAC Name: 2-benzyl-4-(2-methylprop-2-enyl)-1H-triazol-5-one Traditional Name: 2-benzyl-4-(2-methylallyl)-1H-triazol-5-one Formula: C13H15N3O MolecularWeight: 229.2777

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CC1=NN(NC1=O)CC2=CC=CC=C2

Isomeric SMILES

CC(=C)CC1=NN(NC1=O)CC2=CC=CC=C2

InChI

InChI=1S/C13H15N3O/c1-10(2)8-12-13(17)15-16(14-12)9-11-6-4-3-5-7-11/h3-7H,1,8-9H2,2H3,(H,15,17)