(4,5-dimethoxy-2-nitro-phenyl)methyl 5-methyl-2-propyl-benzoate

Systemtic Name: (4,5-dimethoxy-2-nitro-phenyl)methyl 5-methyl-2-propyl-benzoate Openeye Name: (4,5-dimethoxy-2-nitro-phenyl)methyl 5-methyl-2-propyl-benzoate CAS Name: 5-methyl-2-propylbenzoic acid (4,5-dimethoxy-2-nitrophenyl)methyl ester IUPAC Name: (4,5-dimethoxy-2-nitrophenyl)methyl 5-methyl-2-propylbenzoate Traditional Name: 5-methyl-2-propyl-benzoic acid (4,5-dimethoxy-2-nitro-benzyl) ester Formula: C20H23NO6 MolecularWeight: 373.39972

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(C=C1)C)C(=O)OCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

Isomeric SMILES

CCCC1=C(C=C(C=C1)C)C(=O)OCC2=CC(=C(C=C2[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H23NO6/c1-5-6-14-8-7-13(2)9-16(14)20(22)27-12-15-10-18(25-3)19(26-4)11-17(15)21(23)24/h7-11H,5-6,12H2,1-4H3