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

Systemtic Name: ethyl 2-ethyl-4-[[(2R)-oxolan-2-yl]carbonylamino]-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 2-ethyl-4-[[(2R)-tetrahydrofuran-2-carbonyl]amino]-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 2-ethyl-4-[[oxo-[(2R)-2-oxolanyl]methyl]amino]-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-ethyl-4-[[(2R)-oxolane-2-carbonyl]amino]-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 2-ethyl-4-[[(2R)-tetrahydrofuran-2-carbonyl]amino]-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C19H23N3O4 MolecularWeight: 357.40362

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)C3CCCO3)C(=O)OCC

Isomeric SMILES

CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)[C@H]3CCCO3)C(=O)OCC

InChI

InChI=1S/C19H23N3O4/c1-3-12-16(19(24)25-4-2)17(22-18(23)15-10-7-11-26-15)21-14-9-6-5-8-13(14)20-12/h5-6,8-9,15,20H,3-4,7,10-11H2,1-2H3,(H,21,22,23)/t15-/m1/s1