ethyl (1S,5R,7R,8S)-2-methyl-1-nitro-9-oxidanylidene-7-phenyl-4-oxa-3-azaspiro[4.5]dec-2-ene-8-carboxylate

Systemtic Name: ethyl (1S,5R,7R,8S)-2-methyl-1-nitro-9-oxidanylidene-7-phenyl-4-oxa-3-azaspiro[4.5]dec-2-ene-8-carboxylate Openeye Name: ethyl (1S,5R,7R,8S)-2-methyl-1-nitro-9-oxo-7-phenyl-4-oxa-3-azaspiro[4.5]dec-2-ene-8-carboxylate CAS Name: (1S,5R,7R,8S)-2-methyl-1-nitro-9-oxo-7-phenyl-4-oxa-3-azaspiro[4.5]dec-2-ene-8-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,5R,7R,8S)-2-methyl-1-nitro-9-oxo-7-phenyl-4-oxa-3-azaspiro[4.5]dec-2-ene-8-carboxylate Traditional Name: (1S,5R,7R,8S)-9-keto-2-methyl-1-nitro-7-phenyl-4-oxa-3-azaspiro[4.5]dec-2-ene-8-carboxylic acid ethyl ester Formula: C18H20N2O6 MolecularWeight: 360.3612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(CC2(CC1=O)C(C(=NO2)C)[N+](=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@H]1[C@@H](C[C@@]2(CC1=O)[C@H](C(=NO2)C)[N+](=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C18H20N2O6/c1-3-25-17(22)15-13(12-7-5-4-6-8-12)9-18(10-14(15)21)16(20(23)24)11(2)19-26-18/h4-8,13,15-16H,3,9-10H2,1-2H3/t13-,15-,16-,18+/m0/s1