8-[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline

Systemtic Name: 8-[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline Openeye Name: 8-[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline CAS Name: 8-[[6-(1-benzotriazolyl)-5-nitro-4-pyrimidinyl]oxy]-2-methylquinoline IUPAC Name: 8-[6-(benzotriazol-1-yl)-5-nitropyrimidin-4-yl]oxy-2-methylquinoline Traditional Name: 8-[6-(benzotriazol-1-yl)-5-nitro-pyrimidin-4-yl]oxy-2-methyl-quinoline Formula: C20H13N7O3 MolecularWeight: 399.36232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])N4C5=CC=CC=C5N=N4)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2OC3=NC=NC(=C3[N+](=O)[O-])N4C5=CC=CC=C5N=N4)C=C1

InChI

InChI=1S/C20H13N7O3/c1-12-9-10-13-5-4-8-16(17(13)23-12)30-20-18(27(28)29)19(21-11-22-20)26-15-7-3-2-6-14(15)24-25-26/h2-11H,1H3