ethyl 2-methyl-4-[2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoylamino]-1H-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 2-methyl-4-[2-(2-oxidanylidene-1,3-benzoxazol-3-yl)ethanoylamino]-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 2-methyl-4-[[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 2-methyl-4-[[1-oxo-2-(2-oxo-1,3-benzoxazol-3-yl)ethyl]amino]-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-4-[[2-(2-oxo-1,3-benzoxazol-3-yl)acetyl]amino]-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 4-[[2-(2-keto-1,3-benzoxazol-3-yl)acetyl]amino]-2-methyl-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C22H20N4O5 MolecularWeight: 420.418

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=CC=CC=C2N=C1NC(=O)CN3C4=CC=CC=C4OC3=O)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=CC=CC=C2N=C1NC(=O)CN3C4=CC=CC=C4OC3=O)C

InChI

InChI=1S/C22H20N4O5/c1-3-30-21(28)19-13(2)23-14-8-4-5-9-15(14)24-20(19)25-18(27)12-26-16-10-6-7-11-17(16)31-22(26)29/h4-11,23H,3,12H2,1-2H3,(H,24,25,27)