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2-[(2,3-dimethoxy-7-nitro-quinoxalin-5-yl)methylamino]ethylphosphonic acid

2-[(2,3-dimethoxy-7-nitro-quinoxalin-5-yl)methylamino]ethylphosphonic acid

Systemtic Name:2-[(2,3-dimethoxy-7-nitro-quinoxalin-5-yl)methylamino]ethylphosphonic acid
Openeye Name:2-[(2,3-dimethoxy-7-nitro-quinoxalin-5-yl)methylamino]ethylphosphonic acid
CAS Name:2-[(2,3-dimethoxy-7-nitro-5-quinoxalinyl)methylamino]ethylphosphonic acid
IUPAC Name:2-[(2,3-dimethoxy-7-nitroquinoxalin-5-yl)methylamino]ethylphosphonic acid
Traditional Name:2-[(2,3-dimethoxy-7-nitro-quinoxalin-5-yl)methylamino]ethylphosphonic acid
Formula: C13H17N4O7P
MolecularWeight: 372.270441
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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=C(C(=CC(=C2)[N+](=O)[O-])CNCCP(=O)(O)O)N=C1OC


Isomeric SMILES

COC1=NC2=C(C(=CC(=C2)[N+](=O)[O-])CNCCP(=O)(O)O)N=C1OC


InChI

InChI=1S/C13H17N4O7P/c1-23-12-13(24-2)16-11-8(7-14-3-4-25(20,21)22)5-9(17(18)19)6-10(11)15-12/h5-6,14H,3-4,7H2,1-2H3,(H2,20,21,22)


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