4-[(1,3,5-trimethylpyrazolo[4,3-d]pyrimidin-7-yl)amino]benzoic acid

Systemtic Name: 4-[(1,3,5-trimethylpyrazolo[4,3-d]pyrimidin-7-yl)amino]benzoic acid Openeye Name: 4-[(1,3,5-trimethylpyrazolo[4,3-d]pyrimidin-7-yl)amino]benzoic acid CAS Name: 4-[(1,3,5-trimethyl-7-pyrazolo[4,3-d]pyrimidinyl)amino]benzoic acid IUPAC Name: 4-[(1,3,5-trimethylpyrazolo[4,3-d]pyrimidin-7-yl)amino]benzoic acid Traditional Name: 4-[(1,3,5-trimethylpyrazolo[4,3-d]pyrimidin-7-yl)amino]benzoic acid Formula: C15H15N5O2 MolecularWeight: 297.3119

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1N=C(N=C2NC3=CC=C(C=C3)C(=O)O)C)C

Isomeric SMILES

CC1=NN(C2=C1N=C(N=C2NC3=CC=C(C=C3)C(=O)O)C)C

InChI

InChI=1S/C15H15N5O2/c1-8-12-13(20(3)19-8)14(17-9(2)16-12)18-11-6-4-10(5-7-11)15(21)22/h4-7H,1-3H3,(H,21,22)(H,16,17,18)