heptyl 4-nitrobenzoate

Systemtic Name: heptyl 4-nitrobenzoate Openeye Name: heptyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid heptyl ester IUPAC Name: heptyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid heptyl ester Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19NO4/c1-2-3-4-5-6-11-19-14(16)12-7-9-13(10-8-12)15(17)18/h7-10H,2-6,11H2,1H3