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5-nitro-N4-[4-(triphenylmethyl)oxybutyl]pyrimidine-4,6-diamine

5-nitro-N4-[4-(triphenylmethyl)oxybutyl]pyrimidine-4,6-diamine

Systemtic Name:5-nitro-N4-[4-(triphenylmethyl)oxybutyl]pyrimidine-4,6-diamine
Openeye Name:5-nitro-N4-(4-trityloxybutyl)pyrimidine-4,6-diamine
CAS Name:5-nitro-N4-[4-(triphenylmethyl)oxybutyl]pyrimidine-4,6-diamine
IUPAC Name:5-nitro-4-N-(4-trityloxybutyl)pyrimidine-4,6-diamine
Traditional Name:(6-amino-5-nitro-pyrimidin-4-yl)-(4-trityloxybutyl)amine
Formula: C27H27N5O3
MolecularWeight: 469.53498
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCCCCNC4=NC=NC(=C4[N+](=O)[O-])N


Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)OCCCCNC4=NC=NC(=C4[N+](=O)[O-])N


InChI

InChI=1S/C27H27N5O3/c28-25-24(32(33)34)26(31-20-30-25)29-18-10-11-19-35-27(21-12-4-1-5-13-21,22-14-6-2-7-15-22)23-16-8-3-9-17-23/h1-9,12-17,20H,10-11,18-19H2,(H3,28,29,30,31)


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