ethyl (1'S,3S)-5-nitro-2-oxidanylidene-spiro[1H-indole-3,2'-cyclopropane]-1'-carboxylate

Systemtic Name: ethyl (1'S,3S)-5-nitro-2-oxidanylidene-spiro[1H-indole-3,2'-cyclopropane]-1'-carboxylate Openeye Name: ethyl (1S,2S)-5'-nitro-2'-oxo-spiro[cyclopropane-2,3'-indoline]-1-carboxylate CAS Name: (1'S,3S)-5-nitro-2-oxo-1'-spiro[1H-indole-3,2'-cyclopropane]carboxylic acid ethyl ester IUPAC Name: ethyl (1'S,3S)-5-nitro-2-oxospiro[1H-indole-3,2'-cyclopropane]-1'-carboxylate Traditional Name: (1S,2S)-2'-keto-5'-nitro-spiro[cyclopropane-2,3'-indoline]-1-carboxylic acid ethyl ester Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC12C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O

Isomeric SMILES

CCOC(=O)[C@H]1C[C@@]12C3=C(C=CC(=C3)[N+](=O)[O-])NC2=O

InChI

InChI=1S/C13H12N2O5/c1-2-20-11(16)9-6-13(9)8-5-7(15(18)19)3-4-10(8)14-12(13)17/h3-5,9H,2,6H2,1H3,(H,14,17)/t9-,13-/m1/s1