(2-methyl-2-nitro-3-nitrooxy-propyl) (2S)-2-(6-methoxynaphthalen-2-yl)propanoate

Systemtic Name: (2-methyl-2-nitro-3-nitrooxy-propyl) (2S)-2-(6-methoxynaphthalen-2-yl)propanoate Openeye Name: (2-methyl-2-nitro-3-nitrooxy-propyl) (2S)-2-(6-methoxy-2-naphthyl)propanoate CAS Name: (2S)-2-(6-methoxy-2-naphthalenyl)propanoic acid (2-methyl-2-nitro-3-nitrooxypropyl) ester IUPAC Name: (2-methyl-2-nitro-3-nitrooxypropyl) (2S)-2-(6-methoxynaphthalen-2-yl)propanoate Traditional Name: (2S)-2-(6-methoxy-2-naphthyl)propionic acid (2-methyl-2-nitro-3-nitrooxy-propyl) ester Formula: C18H20N2O8 MolecularWeight: 392.36

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)C=C(C=C2)OC)C(=O)OCC(C)(CO[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O8/c1-12(13-4-5-15-9-16(26-3)7-6-14(15)8-13)17(21)27-10-18(2,19(22)23)11-28-20(24)25/h4-9,12H,10-11H2,1-3H3/t12-,18?/m0/s1