methyl 5-(2,3-dihydro-1H-1,2,3,4-tetrazol-5-ylcarbonylimino)-3-methyl-6-oxidanylidene-cyclohexa-1,3-diene-1-carboxylate

Systemtic Name: methyl 5-(2,3-dihydro-1H-1,2,3,4-tetrazol-5-ylcarbonylimino)-3-methyl-6-oxidanylidene-cyclohexa-1,3-diene-1-carboxylate Openeye Name: methyl 5-(2,3-dihydro-1H-tetrazole-5-carbonylimino)-3-methyl-6-oxo-cyclohexa-1,3-diene-1-carboxylate CAS Name: 5-[2,3-dihydro-1H-tetrazol-5-yl(oxo)methyl]imino-3-methyl-6-oxo-1-cyclohexa-1,3-dienecarboxylic acid methyl ester IUPAC Name: methyl 5-(2,3-dihydro-1H-tetrazole-5-carbonylimino)-3-methyl-6-oxocyclohexa-1,3-diene-1-carboxylate Traditional Name: 5-(2,3-dihydro-1H-tetrazole-5-carbonylimino)-6-keto-3-methyl-cyclohexa-1,3-diene-1-carboxylic acid methyl ester Formula: C11H11N5O4 MolecularWeight: 277.23614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=O)C2=NNNN2)C(=O)C(=C1)C(=O)OC

Isomeric SMILES

CC1=CC(=NC(=O)C2=NNNN2)C(=O)C(=C1)C(=O)OC

InChI

InChI=1S/C11H11N5O4/c1-5-3-6(11(19)20-2)8(17)7(4-5)12-10(18)9-13-15-16-14-9/h3-4,15-16H,1-2H3,(H,13,14)