5-nitro-6-(4-propan-2-ylphenoxy)-N-prop-2-enyl-pyrimidin-4-amine

Systemtic Name: 5-nitro-6-(4-propan-2-ylphenoxy)-N-prop-2-enyl-pyrimidin-4-amine Openeye Name: N-allyl-6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-amine CAS Name: 5-nitro-6-(4-propan-2-ylphenoxy)-N-prop-2-enyl-4-pyrimidinamine IUPAC Name: 5-nitro-6-(4-propan-2-ylphenoxy)-N-prop-2-enylpyrimidin-4-amine Traditional Name: allyl-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18N4O3/c1-4-9-17-15-14(20(21)22)16(19-10-18-15)23-13-7-5-12(6-8-13)11(2)3/h4-8,10-11H,1,9H2,2-3H3,(H,17,18,19)