(6Z)-6-[[[(3aR,5S,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-oxidanyl-amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[[[(3aR,5S,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-oxidanyl-amino]methylidene]-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[[[(3aR,5S,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-hydroxy-amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[[[(3aR,5S,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-hydroxyamino]methylidene]-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[[[(3aR,5S,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-hydroxyamino]methylidene]-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[[[(3aR,5S,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-yl]-hydroxy-amino]methylene]-4-nitro-cyclohexa-2,4-dien-1-one Formula: C19H24N2O9 MolecularWeight: 424.40186

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(O1)C2C(C3C(O2)OC(O3)(C)C)N(C=C4C=C(C=CC4=O)[N+](=O)[O-])O)C

Isomeric SMILES

CC1(OC[C@@H](O1)[C@@H]2[C@H]([C@@H]3[C@H](O2)OC(O3)(C)C)N(/C=C\4/C=C(C=CC4=O)[N+](=O)[O-])O)C

InChI

InChI=1S/C19H24N2O9/c1-18(2)26-9-13(28-18)15-14(16-17(27-15)30-19(3,4)29-16)20(23)8-10-7-11(21(24)25)5-6-12(10)22/h5-8,13-17,23H,9H2,1-4H3/b10-8-/t13-,14-,15-,16-,17-/m1/s1