2-chloranyl-3-(1H-1,2,4-triazol-4-ium-4-ylamino)-4a,8a-dihydronaphthalene-1,4-dione

Systemtic Name: 2-chloranyl-3-(1H-1,2,4-triazol-4-ium-4-ylamino)-4a,8a-dihydronaphthalene-1,4-dione Openeye Name: 2-chloro-3-(1H-1,2,4-triazol-4-ium-4-ylamino)-4a,8a-dihydronaphthalene-1,4-dione CAS Name: 2-chloro-3-(1H-1,2,4-triazol-4-ium-4-ylamino)-4a,8a-dihydronaphthalene-1,4-dione IUPAC Name: 2-chloro-3-(1H-1,2,4-triazol-4-ium-4-ylamino)-4a,8a-dihydronaphthalene-1,4-dione Traditional Name: 2-chloro-3-(1H-1,2,4-triazol-4-ium-4-ylamino)-4a,8a-dihydronaphthalene-1,4-quinone Formula: C12H10ClN4O2+ MolecularWeight: 277.6864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2C(C=C1)C(=O)C(=C(C2=O)N[N+]3=CNN=C3)Cl

Isomeric SMILES

C1=CC2C(C=C1)C(=O)C(=C(C2=O)N[N+]3=CNN=C3)Cl

InChI

InChI=1S/C12H9ClN4O2/c13-9-10(16-17-5-14-15-6-17)12(19)8-4-2-1-3-7(8)11(9)18/h1-8H,(H,16,18)/p+1