4-(1H-1,2,4-triazol-5-ylamino)naphthalene-1,2-dione

Systemtic Name: 4-(1H-1,2,4-triazol-5-ylamino)naphthalene-1,2-dione Openeye Name: 4-(1H-1,2,4-triazol-5-ylamino)naphthalene-1,2-dione CAS Name: 4-(1H-1,2,4-triazol-5-ylamino)naphthalene-1,2-dione IUPAC Name: 4-(1H-1,2,4-triazol-5-ylamino)naphthalene-1,2-dione Traditional Name: 4-(1H-1,2,4-triazol-5-ylamino)-1,2-naphthoquinone Formula: C12H8N4O2 MolecularWeight: 240.21752

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=O)C2=O)NC3=NC=NN3

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=O)C2=O)NC3=NC=NN3

InChI

InChI=1S/C12H8N4O2/c17-10-5-9(15-12-13-6-14-16-12)7-3-1-2-4-8(7)11(10)18/h1-6H,(H2,13,14,15,16)