(1S)-N-(2-methoxy-4-nitro-phenyl)-3-oxidanylidene-4-oxaspiro[4.5]decane-1-carboxamide

Systemtic Name: (1S)-N-(2-methoxy-4-nitro-phenyl)-3-oxidanylidene-4-oxaspiro[4.5]decane-1-carboxamide Openeye Name: (1S)-N-(2-methoxy-4-nitro-phenyl)-3-oxo-4-oxaspiro[4.5]decane-1-carboxamide CAS Name: (1S)-N-(2-methoxy-4-nitrophenyl)-3-oxo-4-oxaspiro[4.5]decane-1-carboxamide IUPAC Name: (1S)-N-(2-methoxy-4-nitrophenyl)-3-oxo-4-oxaspiro[4.5]decane-1-carboxamide Traditional Name: (1S)-3-keto-N-(2-methoxy-4-nitro-phenyl)-4-oxaspiro[4.5]decane-1-carboxamide Formula: C17H20N2O6 MolecularWeight: 348.3505

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2CC(=O)OC23CCCCC3

Isomeric SMILES

COC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)[C@H]2CC(=O)OC23CCCCC3

InChI

InChI=1S/C17H20N2O6/c1-24-14-9-11(19(22)23)5-6-13(14)18-16(21)12-10-15(20)25-17(12)7-3-2-4-8-17/h5-6,9,12H,2-4,7-8,10H2,1H3,(H,18,21)/t12-/m1/s1