N-[(4-chlorophenyl)methyl]-6-(4-methoxyphenoxy)-5-nitro-pyrimidin-4-amine

Systemtic Name: N-[(4-chlorophenyl)methyl]-6-(4-methoxyphenoxy)-5-nitro-pyrimidin-4-amine Openeye Name: N-[(4-chlorophenyl)methyl]-6-(4-methoxyphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: N-[(4-chlorophenyl)methyl]-6-(4-methoxyphenoxy)-5-nitro-4-pyrimidinamine IUPAC Name: N-[(4-chlorophenyl)methyl]-6-(4-methoxyphenoxy)-5-nitropyrimidin-4-amine Traditional Name: (4-chlorobenzyl)-[6-(4-methoxyphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C18H15ClN4O4 MolecularWeight: 386.7891

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H15ClN4O4/c1-26-14-6-8-15(9-7-14)27-18-16(23(24)25)17(21-11-22-18)20-10-12-2-4-13(19)5-3-12/h2-9,11H,10H2,1H3,(H,20,21,22)