[(3S)-2-oxidanylideneoxolan-3-yl] 12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxylate

Systemtic Name: [(3S)-2-oxidanylideneoxolan-3-yl] 12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxylate Openeye Name: [(3S)-2-oxotetrahydrofuran-3-yl] 12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxylate CAS Name: 12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxylic acid [(3S)-2-oxo-3-oxolanyl] ester IUPAC Name: [(3S)-2-oxooxolan-3-yl] 12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxylate Traditional Name: 12-keto-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxylic acid [(3S)-2-ketotetrahydrofuran-3-yl] ester Formula: C18H18N2O5 MolecularWeight: 342.34592

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=C(C=CC(=C3)C(=O)OC4CCOC4=O)C(=O)N2CC1

Isomeric SMILES

C1CCC2=NC3=C(C=CC(=C3)C(=O)O[C@H]4CCOC4=O)C(=O)N2CC1

InChI

InChI=1S/C18H18N2O5/c21-16-12-6-5-11(17(22)25-14-7-9-24-18(14)23)10-13(12)19-15-4-2-1-3-8-20(15)16/h5-6,10,14H,1-4,7-9H2/t14-/m0/s1