[6-azanyl-4-(2,4-dimethoxyphenyl)-3-nitro-6-oxidanylidene-hexyl] methanoate

Systemtic Name: [6-azanyl-4-(2,4-dimethoxyphenyl)-3-nitro-6-oxidanylidene-hexyl] methanoate Openeye Name: [6-amino-4-(2,4-dimethoxyphenyl)-3-nitro-6-oxo-hexyl] formate CAS Name: formic acid [6-amino-4-(2,4-dimethoxyphenyl)-3-nitro-6-oxohexyl] ester IUPAC Name: [6-amino-4-(2,4-dimethoxyphenyl)-3-nitro-6-oxohexyl] formate Traditional Name: formic acid [6-amino-4-(2,4-dimethoxyphenyl)-6-keto-3-nitro-hexyl] ester Formula: C15H20N2O7 MolecularWeight: 340.3285

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(CC(=O)N)C(CCOC=O)[N+](=O)[O-])OC

Isomeric SMILES

COC1=CC(=C(C=C1)C(CC(=O)N)C(CCOC=O)[N+](=O)[O-])OC

InChI

InChI=1S/C15H20N2O7/c1-22-10-3-4-11(14(7-10)23-2)12(8-15(16)19)13(17(20)21)5-6-24-9-18/h3-4,7,9,12-13H,5-6,8H2,1-2H3,(H2,16,19)