4-azanylbenzoic acid; pyrimidine-4,5,6-triamine

Systemtic Name: 4-azanylbenzoic acid; pyrimidine-4,5,6-triamine Openeye Name: 4-aminobenzoic acid; pyrimidine-4,5,6-triamine CAS Name: 4-aminobenzoic acid; pyrimidine-4,5,6-triamine IUPAC Name: 4-aminobenzoic acid; pyrimidine-4,5,6-triamine Traditional Name: 4-aminobenzoic acid; (4,6-diaminopyrimidin-5-yl)amine Formula: C11H14N6O2 MolecularWeight: 262.26786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)N.C1=NC(=C(C(=N1)N)N)N

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)N.C1=NC(=C(C(=N1)N)N)N

InChI

InChI=1S/C7H7NO2.C4H7N5/c8-6-3-1-5(2-4-6)7(9)10;5-2-3(6)8-1-9-4(2)7/h1-4H,8H2,(H,9,10);1H,5H2,(H4,6,7,8,9)