2-methyl-N-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]quinolin-8-amine

Systemtic Name: 2-methyl-N-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]quinolin-8-amine Openeye Name: N-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-2-methyl-quinolin-8-amine CAS Name: 2-methyl-N-[5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinyl]-8-quinolinamine IUPAC Name: 2-methyl-N-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]quinolin-8-amine Traditional Name: [6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]-(2-methyl-8-quinolyl)amine Formula: C23H21N5O3 MolecularWeight: 415.44454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC3=C(C(=NC=N3)OC4=CC=C(C=C4)C(C)C)[N+](=O)[O-])C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC3=C(C(=NC=N3)OC4=CC=C(C=C4)C(C)C)[N+](=O)[O-])C=C1

InChI

InChI=1S/C23H21N5O3/c1-14(2)16-9-11-18(12-10-16)31-23-21(28(29)30)22(24-13-25-23)27-19-6-4-5-17-8-7-15(3)26-20(17)19/h4-14H,1-3H3,(H,24,25,27)