1-butyl-1,2,4-triazinane-3,5-dione

Systemtic Name: 1-butyl-1,2,4-triazinane-3,5-dione Openeye Name: 1-butyl-1,2,4-triazinane-3,5-dione CAS Name: 1-butyl-1,2,4-triazinane-3,5-dione IUPAC Name: 1-butyl-1,2,4-triazinane-3,5-dione Traditional Name: 1-butyl-1,2,4-triazinane-3,5-quinone Formula: C7H13N3O2 MolecularWeight: 171.19702

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CC(=O)NC(=O)N1

Isomeric SMILES

CCCCN1CC(=O)NC(=O)N1

InChI

InChI=1S/C7H13N3O2/c1-2-3-4-10-5-6(11)8-7(12)9-10/h2-5H2,1H3,(H2,8,9,11,12)