7-(2-chloranyl-3-methanoyl-4-nitro-phenoxy)heptyl ethanoate

Systemtic Name: 7-(2-chloranyl-3-methanoyl-4-nitro-phenoxy)heptyl ethanoate Openeye Name: 7-(2-chloro-3-formyl-4-nitro-phenoxy)heptyl acetate CAS Name: acetic acid 7-(2-chloro-3-formyl-4-nitrophenoxy)heptyl ester IUPAC Name: 7-(2-chloro-3-formyl-4-nitrophenoxy)heptyl acetate Traditional Name: acetic acid 7-(2-chloro-3-formyl-4-nitro-phenoxy)heptyl ester Formula: C16H20ClNO6 MolecularWeight: 357.7861

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCCCCOC1=C(C(=C(C=C1)[N+](=O)[O-])C=O)Cl

Isomeric SMILES

CC(=O)OCCCCCCCOC1=C(C(=C(C=C1)[N+](=O)[O-])C=O)Cl

InChI

InChI=1S/C16H20ClNO6/c1-12(20)23-9-5-3-2-4-6-10-24-15-8-7-14(18(21)22)13(11-19)16(15)17/h7-8,11H,2-6,9-10H2,1H3