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2-azanyl-3-[4-nitro-2-(2-phosphonoethyl)phenyl]propanoic acid

2-azanyl-3-[4-nitro-2-(2-phosphonoethyl)phenyl]propanoic acid

Systemtic Name:2-azanyl-3-[4-nitro-2-(2-phosphonoethyl)phenyl]propanoic acid
Openeye Name:2-amino-3-[4-nitro-2-(2-phosphonoethyl)phenyl]propanoic acid
CAS Name:2-amino-3-[4-nitro-2-(2-phosphonoethyl)phenyl]propanoic acid
IUPAC Name:2-amino-3-[4-nitro-2-(2-phosphonoethyl)phenyl]propanoic acid
Traditional Name:2-amino-3-[4-nitro-2-(2-phosphonoethyl)phenyl]propionic acid
Formula: C11H15N2O7P
MolecularWeight: 318.219761
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C11H15N2O7P/c12-10(11(14)15)6-7-1-2-9(13(16)17)5-8(7)3-4-21(18,19)20/h1-2,5,10H,3-4,6,12H2,(H,14,15)(H2,18,19,20)


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