[4,5-bis(methoxymethoxy)-6-oxidanylidene-cyclodecyl] 2-nitrobenzoate

Systemtic Name: [4,5-bis(methoxymethoxy)-6-oxidanylidene-cyclodecyl] 2-nitrobenzoate Openeye Name: [4,5-bis(methoxymethoxy)-6-oxo-cyclodecyl] 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid [4,5-bis(methoxymethoxy)-6-oxocyclodecyl] ester IUPAC Name: [4,5-bis(methoxymethoxy)-6-oxocyclodecyl] 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid [6-keto-4,5-bis(methoxymethoxy)cyclodecyl] ester Formula: C21H29NO9 MolecularWeight: 439.45626

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Descriptors Computed from Structure

Canonical SMILES:

COCOC1CCC(CCCCC(=O)C1OCOC)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

COCOC1CCC(CCCCC(=O)C1OCOC)OC(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C21H29NO9/c1-27-13-29-19-12-11-15(7-3-6-10-18(23)20(19)30-14-28-2)31-21(24)16-8-4-5-9-17(16)22(25)26/h4-5,8-9,15,19-20H,3,6-7,10-14H2,1-2H3