6-(4-chloranyl-3,5-dimethyl-phenoxy)-5-nitro-N-prop-2-enyl-pyrimidin-4-amine

Systemtic Name: 6-(4-chloranyl-3,5-dimethyl-phenoxy)-5-nitro-N-prop-2-enyl-pyrimidin-4-amine Openeye Name: N-allyl-6-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-pyrimidin-4-amine CAS Name: 6-(4-chloro-3,5-dimethylphenoxy)-5-nitro-N-prop-2-enyl-4-pyrimidinamine IUPAC Name: 6-(4-chloro-3,5-dimethylphenoxy)-5-nitro-N-prop-2-enylpyrimidin-4-amine Traditional Name: allyl-[6-(4-chloro-3,5-dimethyl-phenoxy)-5-nitro-pyrimidin-4-yl]amine Formula: C15H15ClN4O3 MolecularWeight: 334.7576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])NCC=C

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OC2=NC=NC(=C2[N+](=O)[O-])NCC=C

InChI

InChI=1S/C15H15ClN4O3/c1-4-5-17-14-13(20(21)22)15(19-8-18-14)23-11-6-9(2)12(16)10(3)7-11/h4,6-8H,1,5H2,2-3H3,(H,17,18,19)