methyl 4-(1-nitrohex-5-enyl)benzoate

Systemtic Name: methyl 4-(1-nitrohex-5-enyl)benzoate Openeye Name: methyl 4-(1-nitrohex-5-enyl)benzoate CAS Name: 4-(1-nitrohex-5-enyl)benzoic acid methyl ester IUPAC Name: methyl 4-(1-nitrohex-5-enyl)benzoate Traditional Name: 4-(1-nitrohex-5-enyl)benzoic acid methyl ester Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO4/c1-3-4-5-6-13(15(17)18)11-7-9-12(10-8-11)14(16)19-2/h3,7-10,13H,1,4-6H2,2H3