2-[4-[2,4,7-tris(azanyl)pteridin-6-yl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[2,4,7-tris(azanyl)pteridin-6-yl]phenoxy]ethanoic acid Openeye Name: 2-[4-(2,4,7-triaminopteridin-6-yl)phenoxy]acetic acid CAS Name: 2-[4-(2,4,7-triamino-6-pteridinyl)phenoxy]acetic acid IUPAC Name: 2-[4-(2,4,7-triaminopteridin-6-yl)phenoxy]acetic acid Traditional Name: 2-[4-(2,4,7-triaminopteridin-6-yl)phenoxy]acetic acid Formula: C14H13N7O3 MolecularWeight: 327.29812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(N=C2N)N=C(N=C3N)N)OCC(=O)O

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(N=C2N)N=C(N=C3N)N)OCC(=O)O

InChI

InChI=1S/C14H13N7O3/c15-11-9(6-1-3-7(4-2-6)24-5-8(22)23)18-10-12(16)20-14(17)21-13(10)19-11/h1-4H,5H2,(H,22,23)(H6,15,16,17,19,20,21)