N-(3-cyano-6-oxidanylidene-5-propanoyl-cyclohexa-2,4-dien-1-ylidene)-2,3-dihydro-1H-1,2,3,4-tetrazole-5-carboxamide

Systemtic Name: N-(3-cyano-6-oxidanylidene-5-propanoyl-cyclohexa-2,4-dien-1-ylidene)-2,3-dihydro-1H-1,2,3,4-tetrazole-5-carboxamide Openeye Name: N-(3-cyano-6-oxo-5-propanoyl-cyclohexa-2,4-dien-1-ylidene)-2,3-dihydro-1H-tetrazole-5-carboxamide CAS Name: N-[3-cyano-6-oxo-5-(1-oxopropyl)-1-cyclohexa-2,4-dienylidene]-2,3-dihydro-1H-tetrazole-5-carboxamide IUPAC Name: N-(3-cyano-6-oxo-5-propanoylcyclohexa-2,4-dien-1-ylidene)-2,3-dihydro-1H-tetrazole-5-carboxamide Traditional Name: N-(3-cyano-6-keto-5-propionyl-cyclohexa-2,4-dien-1-ylidene)-2,3-dihydro-1H-tetrazole-5-carboxamide Formula: C12H10N6O3 MolecularWeight: 286.2462

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=CC(=NC(=O)C2=NNNN2)C1=O)C#N

Isomeric SMILES

CCC(=O)C1=CC(=CC(=NC(=O)C2=NNNN2)C1=O)C#N

InChI

InChI=1S/C12H10N6O3/c1-2-9(19)7-3-6(5-13)4-8(10(7)20)14-12(21)11-15-17-18-16-11/h3-4,17-18H,2H2,1H3,(H,15,16)