methyl 1-(2-ethoxy-2-oxidanylidene-ethyl)-4-[1-nitro-4-(oxan-2-yloxy)pentyl]-2-oxidanylidene-cyclopentane-1-carboxylate

Systemtic Name: methyl 1-(2-ethoxy-2-oxidanylidene-ethyl)-4-[1-nitro-4-(oxan-2-yloxy)pentyl]-2-oxidanylidene-cyclopentane-1-carboxylate Openeye Name: methyl 1-(2-ethoxy-2-oxo-ethyl)-4-(1-nitro-4-tetrahydropyran-2-yloxy-pentyl)-2-oxo-cyclopentanecarboxylate CAS Name: 1-(2-ethoxy-2-oxoethyl)-4-[1-nitro-4-(2-oxanyloxy)pentyl]-2-oxo-1-cyclopentanecarboxylic acid methyl ester IUPAC Name: methyl 1-(2-ethoxy-2-oxoethyl)-4-[1-nitro-4-(oxan-2-yloxy)pentyl]-2-oxocyclopentane-1-carboxylate Traditional Name: 1-(2-ethoxy-2-keto-ethyl)-2-keto-4-(1-nitro-4-tetrahydropyran-2-yloxy-pentyl)cyclopentanecarboxylic acid methyl ester Formula: C21H33NO9 MolecularWeight: 443.48802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1(CC(CC1=O)C(CCC(C)OC2CCCCO2)[N+](=O)[O-])C(=O)OC

Isomeric SMILES

CCOC(=O)CC1(CC(CC1=O)C(CCC(C)OC2CCCCO2)[N+](=O)[O-])C(=O)OC

InChI

InChI=1S/C21H33NO9/c1-4-29-18(24)13-21(20(25)28-3)12-15(11-17(21)23)16(22(26)27)9-8-14(2)31-19-7-5-6-10-30-19/h14-16,19H,4-13H2,1-3H3