2-(3-methylbutyl)-1H-1,2,4-triazol-3-one

Systemtic Name: 2-(3-methylbutyl)-1H-1,2,4-triazol-3-one Openeye Name: 2-isopentyl-1H-1,2,4-triazol-3-one CAS Name: 2-(3-methylbutyl)-1H-1,2,4-triazol-3-one IUPAC Name: 2-(3-methylbutyl)-1H-1,2,4-triazol-3-one Traditional Name: 2-isoamyl-1H-1,2,4-triazol-3-one Formula: C7H13N3O MolecularWeight: 155.19762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)N=CN1

Isomeric SMILES

CC(C)CCN1C(=O)N=CN1

InChI

InChI=1S/C7H13N3O/c1-6(2)3-4-10-7(11)8-5-9-10/h5-6H,3-4H2,1-2H3,(H,8,9,11)