5-(6-phenylpyridazin-3-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate

Systemtic Name: 5-(6-phenylpyridazin-3-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate Openeye Name: 5-(6-phenylpyridazin-3-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate CAS Name: 5-(6-phenyl-3-pyridazinyl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate IUPAC Name: 5-(6-phenylpyridazin-3-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate Traditional Name: 5-(6-phenylpyridazin-3-yl)-2,5-diazabicyclo[2.2.1]heptane-2-carboxylate Formula: C16H15N4O2- MolecularWeight: 295.3159

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CN(C1CN2C(=O)[O-])C3=NN=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

C1C2CN(C1CN2C(=O)[O-])C3=NN=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C16H16N4O2/c21-16(22)20-10-12-8-13(20)9-19(12)15-7-6-14(17-18-15)11-4-2-1-3-5-11/h1-7,12-13H,8-10H2,(H,21,22)/p-1