ethyl 4-[(Z)-1-nitropent-1-en-2-yl]benzoate

Systemtic Name: ethyl 4-[(Z)-1-nitropent-1-en-2-yl]benzoate Openeye Name: ethyl 4-[(1Z)-1-(nitromethylene)butyl]benzoate CAS Name: 4-[(Z)-1-nitropent-1-en-2-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(Z)-1-nitropent-1-en-2-yl]benzoate Traditional Name: 4-[(Z)-2-nitro-1-propyl-vinyl]benzoic acid ethyl ester Formula: C14H17NO4 MolecularWeight: 263.28908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC/C(=C/[N+](=O)[O-])/C1=CC=C(C=C1)C(=O)OCC

InChI

InChI=1S/C14H17NO4/c1-3-5-13(10-15(17)18)11-6-8-12(9-7-11)14(16)19-4-2/h6-10H,3-5H2,1-2H3/b13-10-