octyl 3-nitrobenzoate

Systemtic Name: octyl 3-nitrobenzoate Openeye Name: octyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid octyl ester IUPAC Name: octyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid octyl ester Formula: C15H21NO4 MolecularWeight: 279.33154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC(=CC=C1)[N+](=O)[O-]

InChI

InChI=1S/C15H21NO4/c1-2-3-4-5-6-7-11-20-15(17)13-9-8-10-14(12-13)16(18)19/h8-10,12H,2-7,11H2,1H3