3-[2-[4-(5-carbamimidoylpyrimidin-2-yl)phenoxy]ethanoylamino]propanoic acid

Systemtic Name: 3-[2-[4-(5-carbamimidoylpyrimidin-2-yl)phenoxy]ethanoylamino]propanoic acid Openeye Name: 3-[[2-[4-(5-carbamimidoylpyrimidin-2-yl)phenoxy]acetyl]amino]propanoic acid CAS Name: 3-[[2-[4-(5-carbamimidoyl-2-pyrimidinyl)phenoxy]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-[4-(5-carbamimidoylpyrimidin-2-yl)phenoxy]acetyl]amino]propanoic acid Traditional Name: 3-[[2-[4-(5-amidinopyrimidin-2-yl)phenoxy]acetyl]amino]propionic acid Formula: C16H17N5O4 MolecularWeight: 343.33728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC=C(C=N2)C(=N)N)OCC(=O)NCCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=NC=C(C=N2)C(=N)N)OCC(=O)NCCC(=O)O

InChI

InChI=1S/C16H17N5O4/c17-15(18)11-7-20-16(21-8-11)10-1-3-12(4-2-10)25-9-13(22)19-6-5-14(23)24/h1-4,7-8H,5-6,9H2,(H3,17,18)(H,19,22)(H,23,24)