1-oxidanylidene-2-phenyl-3-propyl-1,2,3-triazolidin-1-ium-4-one

Systemtic Name: 1-oxidanylidene-2-phenyl-3-propyl-1,2,3-triazolidin-1-ium-4-one Openeye Name: 1-oxo-2-phenyl-3-propyl-triazolidin-1-ium-4-one CAS Name: 1-oxo-2-phenyl-3-propyl-4-triazolidin-1-iumone IUPAC Name: 1-oxo-2-phenyl-3-propyltriazolidin-1-ium-4-one Traditional Name: 1-keto-2-phenyl-3-propyl-triazolidin-1-ium-4-one Formula: C11H14N3O2+ MolecularWeight: 220.24776

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C[N+](=O)N1C2=CC=CC=C2

Isomeric SMILES

CCCN1C(=O)C[N+](=O)N1C2=CC=CC=C2

InChI

InChI=1S/C11H14N3O2/c1-2-8-12-11(15)9-13(16)14(12)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3/q+1