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

Systemtic Name: 2-methyl-N-(5-nitro-6-propan-2-yloxy-pyrimidin-4-yl)quinolin-8-amine Openeye Name: N-(6-isopropoxy-5-nitro-pyrimidin-4-yl)-2-methyl-quinolin-8-amine CAS Name: 2-methyl-N-(5-nitro-6-propan-2-yloxy-4-pyrimidinyl)-8-quinolinamine IUPAC Name: 2-methyl-N-(5-nitro-6-propan-2-yloxypyrimidin-4-yl)quinolin-8-amine Traditional Name: (6-isopropoxy-5-nitro-pyrimidin-4-yl)-(2-methyl-8-quinolyl)amine Formula: C17H17N5O3 MolecularWeight: 339.34858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17N5O3/c1-10(2)25-17-15(22(23)24)16(18-9-19-17)21-13-6-4-5-12-8-7-11(3)20-14(12)13/h4-10H,1-3H3,(H,18,19,21)