5-[[3,5-dimethoxy-4-(4-nitrophenoxy)phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[3,5-dimethoxy-4-(4-nitrophenoxy)phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3,5-dimethoxy-4-(4-nitrophenoxy)phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3,5-dimethoxy-4-(4-nitrophenoxy)phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3,5-dimethoxy-4-(4-nitrophenoxy)phenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3,5-dimethoxy-4-(4-nitrophenoxy)benzyl]pyrimidin-4-yl]amine Formula: C19H19N5O5 MolecularWeight: 397.38466

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC2=CC=C(C=C2)[N+](=O)[O-])OC)CC3=CN=C(N=C3N)N

Isomeric SMILES

COC1=CC(=CC(=C1OC2=CC=C(C=C2)[N+](=O)[O-])OC)CC3=CN=C(N=C3N)N

InChI

InChI=1S/C19H19N5O5/c1-27-15-8-11(7-12-10-22-19(21)23-18(12)20)9-16(28-2)17(15)29-14-5-3-13(4-6-14)24(25)26/h3-6,8-10H,7H2,1-2H3,(H4,20,21,22,23)