propyl 4-chloranyl-2-ethyl-5-nitro-benzoate

Systemtic Name: propyl 4-chloranyl-2-ethyl-5-nitro-benzoate Openeye Name: propyl 4-chloro-2-ethyl-5-nitro-benzoate CAS Name: 4-chloro-2-ethyl-5-nitrobenzoic acid propyl ester IUPAC Name: propyl 4-chloro-2-ethyl-5-nitrobenzoate Traditional Name: 4-chloro-2-ethyl-5-nitro-benzoic acid propyl ester Formula: C12H14ClNO4 MolecularWeight: 271.69686

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC(=C(C=C1CC)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)C1=CC(=C(C=C1CC)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H14ClNO4/c1-3-5-18-12(15)9-7-11(14(16)17)10(13)6-8(9)4-2/h6-7H,3-5H2,1-2H3