6-(4-methylphenoxy)-5-nitro-N-(oxolan-2-ylmethyl)pyrimidin-4-amine

Systemtic Name: 6-(4-methylphenoxy)-5-nitro-N-(oxolan-2-ylmethyl)pyrimidin-4-amine Openeye Name: 6-(4-methylphenoxy)-5-nitro-N-(tetrahydrofuran-2-ylmethyl)pyrimidin-4-amine CAS Name: 6-(4-methylphenoxy)-5-nitro-N-(2-oxolanylmethyl)-4-pyrimidinamine IUPAC Name: 6-(4-methylphenoxy)-5-nitro-N-(oxolan-2-ylmethyl)pyrimidin-4-amine Traditional Name: [6-(4-methylphenoxy)-5-nitro-pyrimidin-4-yl]-(tetrahydrofurfuryl)amine Formula: C16H18N4O4 MolecularWeight: 330.33852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NCC3CCCO3

Isomeric SMILES

CC1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])NCC3CCCO3

InChI

InChI=1S/C16H18N4O4/c1-11-4-6-12(7-5-11)24-16-14(20(21)22)15(18-10-19-16)17-9-13-3-2-8-23-13/h4-7,10,13H,2-3,8-9H2,1H3,(H,17,18,19)