4-(3-methanoyl-4-nitro-phenoxy)butyl ethanoate

Systemtic Name: 4-(3-methanoyl-4-nitro-phenoxy)butyl ethanoate Openeye Name: 4-(3-formyl-4-nitro-phenoxy)butyl acetate CAS Name: acetic acid 4-(3-formyl-4-nitrophenoxy)butyl ester IUPAC Name: 4-(3-formyl-4-nitrophenoxy)butyl acetate Traditional Name: acetic acid 4-(3-formyl-4-nitro-phenoxy)butyl ester Formula: C13H15NO6 MolecularWeight: 281.2613

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCOC1=CC(=C(C=C1)[N+](=O)[O-])C=O

Isomeric SMILES

CC(=O)OCCCCOC1=CC(=C(C=C1)[N+](=O)[O-])C=O

InChI

InChI=1S/C13H15NO6/c1-10(16)19-6-2-3-7-20-12-4-5-13(14(17)18)11(8-12)9-15/h4-5,8-9H,2-3,6-7H2,1H3