(2-methanoyl-4-nitro-phenyl) 4-(3-methylbutoxy)benzoate

Systemtic Name: (2-methanoyl-4-nitro-phenyl) 4-(3-methylbutoxy)benzoate Openeye Name: (2-formyl-4-nitro-phenyl) 4-isopentyloxybenzoate CAS Name: 4-(3-methylbutoxy)benzoic acid (2-formyl-4-nitrophenyl) ester IUPAC Name: (2-formyl-4-nitrophenyl) 4-(3-methylbutoxy)benzoate Traditional Name: 4-isoamoxybenzoic acid (2-formyl-4-nitro-phenyl) ester Formula: C19H19NO6 MolecularWeight: 357.35726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])C=O

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])C=O

InChI

InChI=1S/C19H19NO6/c1-13(2)9-10-25-17-6-3-14(4-7-17)19(22)26-18-8-5-16(20(23)24)11-15(18)12-21/h3-8,11-13H,9-10H2,1-2H3