2-azanyl-3-[3-(dimethoxyphosphorylmethyl)benzo[g]quinoxalin-2-yl]propanoic acid

Systemtic Name: 2-azanyl-3-[3-(dimethoxyphosphorylmethyl)benzo[g]quinoxalin-2-yl]propanoic acid Openeye Name: 2-amino-3-[3-(dimethoxyphosphorylmethyl)benzo[g]quinoxalin-2-yl]propanoic acid CAS Name: 2-amino-3-[3-(dimethoxyphosphorylmethyl)-2-benzo[g]quinoxalinyl]propanoic acid IUPAC Name: 2-amino-3-[3-(dimethoxyphosphorylmethyl)benzo[g]quinoxalin-2-yl]propanoic acid Traditional Name: 2-amino-3-[3-(dimethoxyphosphorylmethyl)benzo[g]quinoxalin-2-yl]propionic acid Formula: C18H20N3O5P MolecularWeight: 389.342261

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(CC1=NC2=CC3=CC=CC=C3C=C2N=C1CC(C(=O)O)N)OC

Isomeric SMILES

COP(=O)(CC1=NC2=CC3=CC=CC=C3C=C2N=C1CC(C(=O)O)N)OC

InChI

InChI=1S/C18H20N3O5P/c1-25-27(24,26-2)10-17-16(9-13(19)18(22)23)20-14-7-11-5-3-4-6-12(11)8-15(14)21-17/h3-8,13H,9-10,19H2,1-2H3,(H,22,23)