2-(7-carboxy-4-methyl-3-oxidanylidene-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)ethanoate

Systemtic Name: 2-(7-carboxy-4-methyl-3-oxidanylidene-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)ethanoate Openeye Name: 2-(7-carboxy-4-methyl-3-oxo-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)acetate CAS Name: 2-(7-carboxy-4-methyl-3-oxo-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)acetate IUPAC Name: 2-(7-carboxy-4-methyl-3-oxo-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)acetate Traditional Name: 2-(7-carboxy-3-keto-4-methyl-2,5-dihydro-1H-1,4-benzodiazepin-2-yl)acetate Formula: C13H13N2O5- MolecularWeight: 277.25272

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(C=CC(=C2)C(=O)O)NC(C1=O)CC(=O)[O-]

Isomeric SMILES

CN1CC2=C(C=CC(=C2)C(=O)O)NC(C1=O)CC(=O)[O-]

InChI

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