N7-[3-(3-azanylpropylamino)propyl]-6-(4-nitrophenyl)pteridine-2,4,7-triamine

Systemtic Name: N7-[3-(3-azanylpropylamino)propyl]-6-(4-nitrophenyl)pteridine-2,4,7-triamine Openeye Name: N7-[3-(3-aminopropylamino)propyl]-6-(4-nitrophenyl)pteridine-2,4,7-triamine CAS Name: N7-[3-(3-aminopropylamino)propyl]-6-(4-nitrophenyl)pteridine-2,4,7-triamine IUPAC Name: 7-N-[3-(3-aminopropylamino)propyl]-6-(4-nitrophenyl)pteridine-2,4,7-triamine Traditional Name: 3-aminopropyl-[3-[[2,4-diamino-6-(4-nitrophenyl)pteridin-7-yl]amino]propyl]amine Formula: C18H24N10O2 MolecularWeight: 412.44896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(N=C2NCCCNCCCN)N=C(N=C3N)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(N=C2NCCCNCCCN)N=C(N=C3N)N)[N+](=O)[O-]

InChI

InChI=1S/C18H24N10O2/c19-7-1-8-22-9-2-10-23-16-13(11-3-5-12(6-4-11)28(29)30)24-14-15(20)25-18(21)27-17(14)26-16/h3-6,22H,1-2,7-10,19H2,(H5,20,21,23,25,26,27)