1-nitro-3-[(4-nitrophenoxy)methyl-propan-2-yl-phosphoryl]benzene

Systemtic Name: 1-nitro-3-[(4-nitrophenoxy)methyl-propan-2-yl-phosphoryl]benzene Openeye Name: 1-[isopropyl-[(4-nitrophenoxy)methyl]phosphoryl]-3-nitro-benzene CAS Name: 1-nitro-3-[(4-nitrophenoxy)methyl-propan-2-ylphosphoryl]benzene IUPAC Name: 1-nitro-3-[(4-nitrophenoxy)methyl-propan-2-ylphosphoryl]benzene Traditional Name: 1-[isopropyl-[(4-nitrophenoxy)methyl]phosphoryl]-3-nitro-benzene Formula: C16H17N2O6P MolecularWeight: 364.289741

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)P(=O)(COC1=CC=C(C=C1)[N+](=O)[O-])C2=CC=CC(=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)P(=O)(COC1=CC=C(C=C1)[N+](=O)[O-])C2=CC=CC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N2O6P/c1-12(2)25(23,16-5-3-4-14(10-16)18(21)22)11-24-15-8-6-13(7-9-15)17(19)20/h3-10,12H,11H2,1-2H3