2,4-diethylheptyl 4-chloranyl-3-nitro-benzoate

Systemtic Name: 2,4-diethylheptyl 4-chloranyl-3-nitro-benzoate Openeye Name: 2,4-diethylheptyl 4-chloro-3-nitro-benzoate CAS Name: 4-chloro-3-nitrobenzoic acid 2,4-diethylheptyl ester IUPAC Name: 2,4-diethylheptyl 4-chloro-3-nitrobenzoate Traditional Name: 4-chloro-3-nitro-benzoic acid 2,4-diethylheptyl ester Formula: C18H26ClNO4 MolecularWeight: 355.85634

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H26ClNO4/c1-4-7-13(5-2)10-14(6-3)12-24-18(21)15-8-9-16(19)17(11-15)20(22)23/h8-9,11,13-14H,4-7,10,12H2,1-3H3