2-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-1,2,4,5-tetrahydro-1,4-benzodiazepine-7-carboxylic acid

Systemtic Name: 2-(2-methoxy-2-oxidanylidene-ethyl)-3-oxidanylidene-1,2,4,5-tetrahydro-1,4-benzodiazepine-7-carboxylic acid Openeye Name: 2-(2-methoxy-2-oxo-ethyl)-3-oxo-1,2,4,5-tetrahydro-1,4-benzodiazepine-7-carboxylic acid CAS Name: 2-(2-methoxy-2-oxoethyl)-3-oxo-1,2,4,5-tetrahydro-1,4-benzodiazepine-7-carboxylic acid IUPAC Name: 2-(2-methoxy-2-oxoethyl)-3-oxo-1,2,4,5-tetrahydro-1,4-benzodiazepine-7-carboxylic acid Traditional Name: 3-keto-2-(2-keto-2-methoxy-ethyl)-1,2,4,5-tetrahydro-1,4-benzodiazepine-7-carboxylic acid Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)NCC2=C(N1)C=CC(=C2)C(=O)O

Isomeric SMILES

COC(=O)CC1C(=O)NCC2=C(N1)C=CC(=C2)C(=O)O

InChI

InChI=1S/C13H14N2O5/c1-20-11(16)5-10-12(17)14-6-8-4-7(13(18)19)2-3-9(8)15-10/h2-4,10,15H,5-6H2,1H3,(H,14,17)(H,18,19)