1-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]-2,3-dihydroindole

Systemtic Name: 1-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]-2,3-dihydroindole Openeye Name: 1-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]indoline CAS Name: 1-[5-nitro-6-(4-propan-2-ylphenoxy)-4-pyrimidinyl]-2,3-dihydroindole IUPAC Name: 1-[5-nitro-6-(4-propan-2-ylphenoxy)pyrimidin-4-yl]-2,3-dihydroindole Traditional Name: 1-[6-(4-isopropylphenoxy)-5-nitro-pyrimidin-4-yl]indoline Formula: C21H20N4O3 MolecularWeight: 376.4085

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C43

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC2=NC=NC(=C2[N+](=O)[O-])N3CCC4=CC=CC=C43

InChI

InChI=1S/C21H20N4O3/c1-14(2)15-7-9-17(10-8-15)28-21-19(25(26)27)20(22-13-23-21)24-12-11-16-5-3-4-6-18(16)24/h3-10,13-14H,11-12H2,1-2H3