4-carbamimidoyl-2-[[7-(hydroxymethyl)-6-oxidanylidene-7,8-dihydro-5H-pteridin-2-yl]oxy]benzoic acid

Systemtic Name: 4-carbamimidoyl-2-[[7-(hydroxymethyl)-6-oxidanylidene-7,8-dihydro-5H-pteridin-2-yl]oxy]benzoic acid Openeye Name: 4-carbamimidoyl-2-[[7-(hydroxymethyl)-6-oxo-7,8-dihydro-5H-pteridin-2-yl]oxy]benzoic acid CAS Name: 4-carbamimidoyl-2-[[7-(hydroxymethyl)-6-oxo-7,8-dihydro-5H-pteridin-2-yl]oxy]benzoic acid IUPAC Name: 4-carbamimidoyl-2-[[7-(hydroxymethyl)-6-oxo-7,8-dihydro-5H-pteridin-2-yl]oxy]benzoic acid Traditional Name: 4-amidino-2-[(6-keto-7-methylol-7,8-dihydro-5H-pteridin-2-yl)oxy]benzoic acid Formula: C15H14N6O5 MolecularWeight: 358.30886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=N)N)OC2=NC=C3C(=N2)NC(C(=O)N3)CO)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1C(=N)N)OC2=NC=C3C(=N2)NC(C(=O)N3)CO)C(=O)O

InChI

InChI=1S/C15H14N6O5/c16-11(17)6-1-2-7(14(24)25)10(3-6)26-15-18-4-8-12(21-15)19-9(5-22)13(23)20-8/h1-4,9,22H,5H2,(H3,16,17)(H,20,23)(H,24,25)(H,18,19,21)