5-(2-chloranyl-3-methanoyl-4-nitro-phenoxy)pentyl ethanoate

Systemtic Name: 5-(2-chloranyl-3-methanoyl-4-nitro-phenoxy)pentyl ethanoate Openeye Name: 5-(2-chloro-3-formyl-4-nitro-phenoxy)pentyl acetate CAS Name: acetic acid 5-(2-chloro-3-formyl-4-nitrophenoxy)pentyl ester IUPAC Name: 5-(2-chloro-3-formyl-4-nitrophenoxy)pentyl acetate Traditional Name: acetic acid 5-(2-chloro-3-formyl-4-nitro-phenoxy)pentyl ester Formula: C14H16ClNO6 MolecularWeight: 329.73294

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCCOC1=C(C(=C(C=C1)[N+](=O)[O-])C=O)Cl

Isomeric SMILES

CC(=O)OCCCCCOC1=C(C(=C(C=C1)[N+](=O)[O-])C=O)Cl

InChI

InChI=1S/C14H16ClNO6/c1-10(18)21-7-3-2-4-8-22-13-6-5-12(16(19)20)11(9-17)14(13)15/h5-6,9H,2-4,7-8H2,1H3