[(E)-oct-3-en-2-yl] 4-nitrobenzoate

Systemtic Name: [(E)-oct-3-en-2-yl] 4-nitrobenzoate Openeye Name: [(E)-1-methylhept-2-enyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(E)-oct-3-en-2-yl] ester IUPAC Name: [(E)-oct-3-en-2-yl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(E)-1-methylhept-2-enyl] ester Formula: C15H19NO4 MolecularWeight: 277.31566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO4/c1-3-4-5-6-7-12(2)20-15(17)13-8-10-14(11-9-13)16(18)19/h6-12H,3-5H2,1-2H3/b7-6+