3-(3,5-dinitrophenyl)-1-[3-(3,5-dinitrophenyl)naphthalen-1-yl]naphthalene phosphate

Systemtic Name: 3-(3,5-dinitrophenyl)-1-[3-(3,5-dinitrophenyl)naphthalen-1-yl]naphthalene phosphate Openeye Name: 3-(3,5-dinitrophenyl)-1-[3-(3,5-dinitrophenyl)-1-naphthyl]naphthalene phosphate CAS Name: 3-(3,5-dinitrophenyl)-1-[3-(3,5-dinitrophenyl)-1-naphthalenyl]naphthalene phosphate IUPAC Name: 3-(3,5-dinitrophenyl)-1-[3-(3,5-dinitrophenyl)naphthalen-1-yl]naphthalene phosphate Traditional Name: 3-(3,5-dinitrophenyl)-1-[3-(3,5-dinitrophenyl)-1-naphthyl]naphthalene phosphate Formula: C32H18N4O12P-3 MolecularWeight: 681.478681

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C=C2C3=CC(=CC4=CC=CC=C43)C5=CC(=CC(=C5)[N+](=O)[O-])[N+](=O)[O-])C6=CC(=CC(=C6)[N+](=O)[O-])[N+](=O)[O-].[O-]P(=O)([O-])[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C=C2C3=CC(=CC4=CC=CC=C43)C5=CC(=CC(=C5)[N+](=O)[O-])[N+](=O)[O-])C6=CC(=CC(=C6)[N+](=O)[O-])[N+](=O)[O-].[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C32H18N4O8.H3O4P/c37-33(38)25-11-23(12-26(17-25)34(39)40)21-9-19-5-1-3-7-29(19)31(15-21)32-16-22(10-20-6-2-4-8-30(20)32)24-13-27(35(41)42)18-28(14-24)36(43)44;1-5(2,3)4/h1-18H;(H3,1,2,3,4)/p-3