2-(5-nitro-6-propan-2-yloxy-pyrimidin-4-yl)-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-(5-nitro-6-propan-2-yloxy-pyrimidin-4-yl)-3,4-dihydro-1H-isoquinoline Openeye Name: 2-(6-isopropoxy-5-nitro-pyrimidin-4-yl)-3,4-dihydro-1H-isoquinoline CAS Name: 2-(5-nitro-6-propan-2-yloxy-4-pyrimidinyl)-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-(5-nitro-6-propan-2-yloxypyrimidin-4-yl)-3,4-dihydro-1H-isoquinoline Traditional Name: 2-(6-isopropoxy-5-nitro-pyrimidin-4-yl)-3,4-dihydro-1H-isoquinoline Formula: C16H18N4O3 MolecularWeight: 314.33912

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC=NC(=C1[N+](=O)[O-])N2CCC3=CC=CC=C3C2

Isomeric SMILES

CC(C)OC1=NC=NC(=C1[N+](=O)[O-])N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C16H18N4O3/c1-11(2)23-16-14(20(21)22)15(17-10-18-16)19-8-7-12-5-3-4-6-13(12)9-19/h3-6,10-11H,7-9H2,1-2H3