methyl 2-[2-nitro-3-(2,5,5-trimethyl-1,3-dioxan-2-yl)phenoxy]ethanoate

Systemtic Name: methyl 2-[2-nitro-3-(2,5,5-trimethyl-1,3-dioxan-2-yl)phenoxy]ethanoate Openeye Name: methyl 2-[2-nitro-3-(2,5,5-trimethyl-1,3-dioxan-2-yl)phenoxy]acetate CAS Name: 2-[2-nitro-3-(2,5,5-trimethyl-1,3-dioxan-2-yl)phenoxy]acetic acid methyl ester IUPAC Name: methyl 2-[2-nitro-3-(2,5,5-trimethyl-1,3-dioxan-2-yl)phenoxy]acetate Traditional Name: 2-[2-nitro-3-(2,5,5-trimethyl-1,3-dioxan-2-yl)phenoxy]acetic acid methyl ester Formula: C16H21NO7 MolecularWeight: 339.34044

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)(C)C2=C(C(=CC=C2)OCC(=O)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1(COC(OC1)(C)C2=C(C(=CC=C2)OCC(=O)OC)[N+](=O)[O-])C

InChI

InChI=1S/C16H21NO7/c1-15(2)9-23-16(3,24-10-15)11-6-5-7-12(14(11)17(19)20)22-8-13(18)21-4/h5-7H,8-10H2,1-4H3