[5-(3-nitrophenyl)-1-phosphono-pent-1-enyl]phosphonic acid

Systemtic Name: [5-(3-nitrophenyl)-1-phosphono-pent-1-enyl]phosphonic acid Openeye Name: [5-(3-nitrophenyl)-1-phosphono-pent-1-enyl]phosphonic acid CAS Name: [5-(3-nitrophenyl)-1-phosphonopent-1-enyl]phosphonic acid IUPAC Name: [5-(3-nitrophenyl)-1-phosphonopent-1-enyl]phosphonic acid Traditional Name: [5-(3-nitrophenyl)-1-phosphono-pent-1-enyl]phosphonic acid Formula: C11H15NO8P2 MolecularWeight: 351.186222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H15NO8P2/c13-12(14)10-6-3-5-9(8-10)4-1-2-7-11(21(15,16)17)22(18,19)20/h3,5-8H,1-2,4H2,(H2,15,16,17)(H2,18,19,20)