4-(5-azanyl-1,2-dihydro-1,2,4-triazol-3-ylidene)-2-chloranyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(5-azanyl-1,2-dihydro-1,2,4-triazol-3-ylidene)-2-chloranyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-(5-amino-1,2-dihydro-1,2,4-triazol-3-ylidene)-2-chloro-cyclohexa-2,5-dien-1-one CAS Name: 4-(5-amino-1,2-dihydro-1,2,4-triazol-3-ylidene)-2-chloro-1-cyclohexa-2,5-dienone IUPAC Name: 4-(5-amino-1,2-dihydro-1,2,4-triazol-3-ylidene)-2-chlorocyclohexa-2,5-dien-1-one Traditional Name: 4-(5-amino-1,2-dihydro-1,2,4-triazol-3-ylidene)-2-chloro-cyclohexa-2,5-dien-1-one Formula: C8H7ClN4O MolecularWeight: 210.62038

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C(=CC1=C2NNC(=N2)N)Cl

Isomeric SMILES

C1=CC(=O)C(=CC1=C2NNC(=N2)N)Cl

InChI

InChI=1S/C8H7ClN4O/c9-5-3-4(1-2-6(5)14)7-11-8(10)13-12-7/h1-3,12H,(H3,10,11,13)