carbon monoxide; chromium; methyl 7-chloranyl-2-oxidanylidene-1,3-dihydro-1,4-benzodiazepine-5-carboxylate

Systemtic Name: carbon monoxide; chromium; methyl 7-chloranyl-2-oxidanylidene-1,3-dihydro-1,4-benzodiazepine-5-carboxylate Openeye Name: carbon monoxide; chromium; methyl 7-chloro-2-oxo-1,3-dihydro-1,4-benzodiazepine-5-carboxylate CAS Name: carbon monoxide; 7-chloro-2-oxo-1,3-dihydro-1,4-benzodiazepine-5-carboxylic acid methyl ester; chromium IUPAC Name: carbon monoxide; chromium; methyl 7-chloro-2-oxo-1,3-dihydro-1,4-benzodiazepine-5-carboxylate Traditional Name: carbon monoxide; 7-chloro-2-keto-1,3-dihydro-1,4-benzodiazepine-5-carboxylic acid methyl ester; chromium Formula: C14H9ClCrN2O6 MolecularWeight: 388.68016

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=NCC(=O)NC2=C1C=C(C=C2)Cl.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]

Isomeric SMILES

COC(=O)C1=NCC(=O)NC2=C1C=C(C=C2)Cl.[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]

InChI

InChI=1S/C11H9ClN2O3.3CO.Cr/c1-17-11(16)10-7-4-6(12)2-3-8(7)14-9(15)5-13-10;3*1-2;/h2-4H,5H2,1H3,(H,14,15);;;;