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

Systemtic Name: N-(5-butanoyl-3-methyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)-2,3-dihydro-1H-1,2,3,4-tetrazole-5-carboxamide Openeye Name: N-(5-butanoyl-3-methyl-6-oxo-cyclohexa-2,4-dien-1-ylidene)-2,3-dihydro-1H-tetrazole-5-carboxamide CAS Name: N-[3-methyl-6-oxo-5-(1-oxobutyl)-1-cyclohexa-2,4-dienylidene]-2,3-dihydro-1H-tetrazole-5-carboxamide IUPAC Name: N-(5-butanoyl-3-methyl-6-oxocyclohexa-2,4-dien-1-ylidene)-2,3-dihydro-1H-tetrazole-5-carboxamide Traditional Name: N-(5-butyryl-6-keto-3-methyl-cyclohexa-2,4-dien-1-ylidene)-2,3-dihydro-1H-tetrazole-5-carboxamide Formula: C13H15N5O3 MolecularWeight: 289.2899

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CC(=CC(=NC(=O)C2=NNNN2)C1=O)C

Isomeric SMILES

CCCC(=O)C1=CC(=CC(=NC(=O)C2=NNNN2)C1=O)C

InChI

InChI=1S/C13H15N5O3/c1-3-4-10(19)8-5-7(2)6-9(11(8)20)14-13(21)12-15-17-18-16-12/h5-6,17-18H,3-4H2,1-2H3,(H,15,16)