(2-oxidanylidene-2-phenylazanyl-ethyl) 2-[(1S,2R,3S)-3-methyl-2-(nitromethyl)-5-oxidanylidene-cyclopentyl]ethanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) 2-[(1S,2R,3S)-3-methyl-2-(nitromethyl)-5-oxidanylidene-cyclopentyl]ethanoate Openeye Name: (2-anilino-2-oxo-ethyl) 2-[(1S,2R,3S)-3-methyl-2-(nitromethyl)-5-oxo-cyclopentyl]acetate CAS Name: 2-[(1S,2R,3S)-3-methyl-2-(nitromethyl)-5-oxocyclopentyl]acetic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) 2-[(1S,2R,3S)-3-methyl-2-(nitromethyl)-5-oxocyclopentyl]acetate Traditional Name: 2-[(1S,2R,3S)-5-keto-3-methyl-2-(nitromethyl)cyclopentyl]acetic acid (2-anilino-2-keto-ethyl) ester Formula: C17H20N2O6 MolecularWeight: 348.3505

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C(C1C[N+](=O)[O-])CC(=O)OCC(=O)NC2=CC=CC=C2

Isomeric SMILES

C[C@H]1CC(=O)[C@H]([C@@H]1C[N+](=O)[O-])CC(=O)OCC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C17H20N2O6/c1-11-7-15(20)13(14(11)9-19(23)24)8-17(22)25-10-16(21)18-12-5-3-2-4-6-12/h2-6,11,13-14H,7-10H2,1H3,(H,18,21)/t11-,13-,14+/m0/s1