4-[[2,4-bis(azanyl)-7-oxidanylidene-8H-pteridin-6-yl]methyl-methyl-amino]benzoic acid

Systemtic Name: 4-[[2,4-bis(azanyl)-7-oxidanylidene-8H-pteridin-6-yl]methyl-methyl-amino]benzoic acid Openeye Name: 4-[(2,4-diamino-7-oxo-8H-pteridin-6-yl)methyl-methyl-amino]benzoic acid CAS Name: 4-[(2,4-diamino-7-oxo-8H-pteridin-6-yl)methyl-methylamino]benzoic acid IUPAC Name: 4-[(2,4-diamino-7-oxo-8H-pteridin-6-yl)methyl-methylamino]benzoic acid Traditional Name: 4-[(2,4-diamino-7-keto-8H-pteridin-6-yl)methyl-methyl-amino]benzoic acid Formula: C15H15N7O3 MolecularWeight: 341.3247

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC2=C(NC1=O)N=C(N=C2N)N)C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CN(CC1=NC2=C(NC1=O)N=C(N=C2N)N)C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C15H15N7O3/c1-22(8-4-2-7(3-5-8)14(24)25)6-9-13(23)20-12-10(18-9)11(16)19-15(17)21-12/h2-5H,6H2,1H3,(H,24,25)(H5,16,17,19,20,21,23)