6-[4-[(4-nitrophenyl)methyl]phenyl]pteridine-2,4,7-triamine

Systemtic Name: 6-[4-[(4-nitrophenyl)methyl]phenyl]pteridine-2,4,7-triamine Openeye Name: 6-[4-[(4-nitrophenyl)methyl]phenyl]pteridine-2,4,7-triamine CAS Name: 6-[4-[(4-nitrophenyl)methyl]phenyl]pteridine-2,4,7-triamine IUPAC Name: 6-[4-[(4-nitrophenyl)methyl]phenyl]pteridine-2,4,7-triamine Traditional Name: [2,4-diamino-6-[4-(4-nitrobenzyl)phenyl]pteridin-7-yl]amine Formula: C19H16N8O2 MolecularWeight: 388.38274

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CC=C(C=C2)[N+](=O)[O-])C3=NC4=C(N=C3N)N=C(N=C4N)N

Isomeric SMILES

C1=CC(=CC=C1CC2=CC=C(C=C2)[N+](=O)[O-])C3=NC4=C(N=C3N)N=C(N=C4N)N

InChI

InChI=1S/C19H16N8O2/c20-16-14(23-15-17(21)25-19(22)26-18(15)24-16)12-5-1-10(2-6-12)9-11-3-7-13(8-4-11)27(28)29/h1-8H,9H2,(H6,20,21,22,24,25,26)