(4,5-dimethoxy-2-nitro-phenyl)methyl heptanoate

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)methyl heptanoate Openeye Name: (4,5-dimethoxy-2-nitro-phenyl)methyl heptanoate CAS Name: heptanoic acid (4,5-dimethoxy-2-nitrophenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)methyl heptanoate Traditional Name: enanthic acid (4,5-dimethoxy-2-nitro-benzyl) ester Formula: C16H23NO6 MolecularWeight: 325.35692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)OCC1=CC(=C(C=C1[N+](=O)[O-])OC)OC

Isomeric SMILES

CCCCCCC(=O)OCC1=CC(=C(C=C1[N+](=O)[O-])OC)OC

InChI

InChI=1S/C16H23NO6/c1-4-5-6-7-8-16(18)23-11-12-9-14(21-2)15(22-3)10-13(12)17(19)20/h9-10H,4-8,11H2,1-3H3