butyl 3-nitrobenzoate

Systemtic Name: butyl 3-nitrobenzoate Openeye Name: butyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid butyl ester IUPAC Name: butyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid butyl ester Formula: C11H13NO4 MolecularWeight: 223.22522

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO4/c1-2-3-7-16-11(13)9-5-4-6-10(8-9)12(14)15/h4-6,8H,2-3,7H2,1H3