(2S)-2-[6-methoxy-5-[(2-methyl-2-nitrooxy-1,3-dioxan-5-yl)methyl]naphthalen-2-yl]propanoate

Systemtic Name: (2S)-2-[6-methoxy-5-[(2-methyl-2-nitrooxy-1,3-dioxan-5-yl)methyl]naphthalen-2-yl]propanoate Openeye Name: (2S)-2-[6-methoxy-5-[(2-methyl-2-nitrooxy-1,3-dioxan-5-yl)methyl]-2-naphthyl]propanoate CAS Name: (2S)-2-[6-methoxy-5-[(2-methyl-2-nitrooxy-1,3-dioxan-5-yl)methyl]-2-naphthalenyl]propanoate IUPAC Name: (2S)-2-[6-methoxy-5-[(2-methyl-2-nitrooxy-1,3-dioxan-5-yl)methyl]naphthalen-2-yl]propanoate Traditional Name: (2S)-2-[6-methoxy-5-[(2-methyl-2-nitrooxy-1,3-dioxan-5-yl)methyl]-2-naphthyl]propionate Formula: C20H22NO8- MolecularWeight: 404.39058

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C(=C(C=C2)OC)CC3COC(OC3)(C)O[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C[C@@H](C1=CC2=C(C=C1)C(=C(C=C2)OC)CC3COC(OC3)(C)O[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C20H23NO8/c1-12(19(22)23)14-4-6-16-15(9-14)5-7-18(26-3)17(16)8-13-10-27-20(2,28-11-13)29-21(24)25/h4-7,9,12-13H,8,10-11H2,1-3H3,(H,22,23)/p-1/t12-,13?,20?/m0/s1