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2-azanyl-3-[6,7-dimethyl-3-(phosphonomethyl)quinoxalin-2-yl]propanoic acid

2-azanyl-3-[6,7-dimethyl-3-(phosphonomethyl)quinoxalin-2-yl]propanoic acid

Systemtic Name:2-azanyl-3-[6,7-dimethyl-3-(phosphonomethyl)quinoxalin-2-yl]propanoic acid
Openeye Name:2-amino-3-[6,7-dimethyl-3-(phosphonomethyl)quinoxalin-2-yl]propanoic acid
CAS Name:2-amino-3-[6,7-dimethyl-3-(phosphonomethyl)-2-quinoxalinyl]propanoic acid
IUPAC Name:2-amino-3-[6,7-dimethyl-3-(phosphonomethyl)quinoxalin-2-yl]propanoic acid
Traditional Name:2-amino-3-[6,7-dimethyl-3-(phosphonomethyl)quinoxalin-2-yl]propionic acid
Formula: C14H18N3O5P
MolecularWeight: 339.283581
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(C(=N2)CC(C(=O)O)N)CP(=O)(O)O


Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(C(=N2)CC(C(=O)O)N)CP(=O)(O)O


InChI

InChI=1S/C14H18N3O5P/c1-7-3-10-11(4-8(7)2)17-13(6-23(20,21)22)12(16-10)5-9(15)14(18)19/h3-4,9H,5-6,15H2,1-2H3,(H,18,19)(H2,20,21,22)


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