butyl 2-chloroethyl (4-nitrophenyl) phosphate

Systemtic Name: butyl 2-chloroethyl (4-nitrophenyl) phosphate Openeye Name: butyl 2-chloroethyl (4-nitrophenyl) phosphate CAS Name: phosphoric acid butyl 2-chloroethyl (4-nitrophenyl) ester IUPAC Name: butyl 2-chloroethyl (4-nitrophenyl) phosphate Traditional Name: phosphoric acid butyl 2-chloroethyl (4-nitrophenyl) ester Formula: C12H17ClNO6P MolecularWeight: 337.693241

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOP(=O)(OCCCl)OC1=CC=C(C=C1)[N+](=O)[O-]

Isomeric SMILES

CCCCOP(=O)(OCCCl)OC1=CC=C(C=C1)[N+](=O)[O-]

InChI

InChI=1S/C12H17ClNO6P/c1-2-3-9-18-21(17,19-10-8-13)20-12-6-4-11(5-7-12)14(15)16/h4-7H,2-3,8-10H2,1H3