4-[(6-oxidanylidene-8-phenyl-5,7-dihydropteridin-2-yl)amino]benzoic acid

Systemtic Name: 4-[(6-oxidanylidene-8-phenyl-5,7-dihydropteridin-2-yl)amino]benzoic acid Openeye Name: 4-[(6-oxo-8-phenyl-5,7-dihydropteridin-2-yl)amino]benzoic acid CAS Name: 4-[(6-oxo-8-phenyl-5,7-dihydropteridin-2-yl)amino]benzoic acid IUPAC Name: 4-[(6-oxo-8-phenyl-5,7-dihydropteridin-2-yl)amino]benzoic acid Traditional Name: 4-[(6-keto-8-phenyl-5,7-dihydropteridin-2-yl)amino]benzoic acid Formula: C19H15N5O3 MolecularWeight: 361.3541

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=CN=C(N=C2N1C3=CC=CC=C3)NC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1C(=O)NC2=CN=C(N=C2N1C3=CC=CC=C3)NC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C19H15N5O3/c25-16-11-24(14-4-2-1-3-5-14)17-15(22-16)10-20-19(23-17)21-13-8-6-12(7-9-13)18(26)27/h1-10H,11H2,(H,22,25)(H,26,27)(H,20,21,23)