hexadecyl (3-nitro-4-oxidanyl-phenyl) carbonate

Systemtic Name: hexadecyl (3-nitro-4-oxidanyl-phenyl) carbonate Openeye Name: hexadecyl (4-hydroxy-3-nitro-phenyl) carbonate CAS Name: carbonic acid hexadecyl (4-hydroxy-3-nitrophenyl) ester IUPAC Name: hexadecyl (4-hydroxy-3-nitrophenyl) carbonate Traditional Name: carbonic acid cetyl (4-hydroxy-3-nitro-phenyl) ester Formula: C23H37NO6 MolecularWeight: 423.54298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H37NO6/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-18-29-23(26)30-20-16-17-22(25)21(19-20)24(27)28/h16-17,19,25H,2-15,18H2,1H3