tris(2,3-dimethyl-4-nitro-phenyl) phosphate

Systemtic Name: tris(2,3-dimethyl-4-nitro-phenyl) phosphate Openeye Name: tris(2,3-dimethyl-4-nitro-phenyl) phosphate CAS Name: phosphoric acid tris(2,3-dimethyl-4-nitrophenyl) ester IUPAC Name: tris(2,3-dimethyl-4-nitrophenyl) phosphate Traditional Name: phosphoric acid tris(2,3-dimethyl-4-nitro-phenyl) ester Formula: C24H24N3O10P MolecularWeight: 545.435221

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C)OP(=O)(OC2=C(C(=C(C=C2)[N+](=O)[O-])C)C)OC3=C(C(=C(C=C3)[N+](=O)[O-])C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1C)OP(=O)(OC2=C(C(=C(C=C2)[N+](=O)[O-])C)C)OC3=C(C(=C(C=C3)[N+](=O)[O-])C)C)[N+](=O)[O-]

InChI

InChI=1S/C24H24N3O10P/c1-13-16(4)22(10-7-19(13)25(28)29)35-38(34,36-23-11-8-20(26(30)31)14(2)17(23)5)37-24-12-9-21(27(32)33)15(3)18(24)6/h7-12H,1-6H3