ethyl 2-ethyl-4-[(2-oxidanylidenechromen-3-yl)carbonylamino]-1H-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 2-ethyl-4-[(2-oxidanylidenechromen-3-yl)carbonylamino]-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 2-ethyl-4-[(2-oxochromene-3-carbonyl)amino]-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 2-ethyl-4-[[oxo-(2-oxo-1-benzopyran-3-yl)methyl]amino]-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-ethyl-4-[(2-oxochromene-3-carbonyl)amino]-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 2-ethyl-4-[(2-ketochromene-3-carbonyl)amino]-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C24H21N3O5 MolecularWeight: 431.44064

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)C3=CC4=CC=CC=C4OC3=O)C(=O)OCC

Isomeric SMILES

CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)C3=CC4=CC=CC=C4OC3=O)C(=O)OCC

InChI

InChI=1S/C24H21N3O5/c1-3-16-20(24(30)31-4-2)21(26-18-11-7-6-10-17(18)25-16)27-22(28)15-13-14-9-5-8-12-19(14)32-23(15)29/h5-13,25H,3-4H2,1-2H3,(H,26,27,28)