3,3,5-trimethyl-7-(6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-yl)-7-azabicyclo[3.2.1]octane

Systemtic Name: 3,3,5-trimethyl-7-(6-naphthalen-2-yloxy-5-nitro-pyrimidin-4-yl)-7-azabicyclo[3.2.1]octane Openeye Name: 3,3,5-trimethyl-7-[6-(2-naphthyloxy)-5-nitro-pyrimidin-4-yl]-7-azabicyclo[3.2.1]octane CAS Name: 3,3,5-trimethyl-7-[6-(2-naphthalenyloxy)-5-nitro-4-pyrimidinyl]-7-azabicyclo[3.2.1]octane IUPAC Name: 3,3,5-trimethyl-7-(6-naphthalen-2-yloxy-5-nitropyrimidin-4-yl)-7-azabicyclo[3.2.1]octane Traditional Name: 3,3,5-trimethyl-7-[6-(2-naphthoxy)-5-nitro-pyrimidin-4-yl]-7-azabicyclo[3.2.1]octane Formula: C24H26N4O3 MolecularWeight: 418.48824

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2CC(C1)(CN2C3=C(C(=NC=N3)OC4=CC5=CC=CC=C5C=C4)[N+](=O)[O-])C)C

Isomeric SMILES

CC1(CC2CC(C1)(CN2C3=C(C(=NC=N3)OC4=CC5=CC=CC=C5C=C4)[N+](=O)[O-])C)C

InChI

InChI=1S/C24H26N4O3/c1-23(2)11-18-12-24(3,13-23)14-27(18)21-20(28(29)30)22(26-15-25-21)31-19-9-8-16-6-4-5-7-17(16)10-19/h4-10,15,18H,11-14H2,1-3H3