3-[3-fluoranyl-4-[(2S)-octan-2-yl]oxy-phenyl]-6-(4-nonylphenyl)pyridazine

Systemtic Name: 3-[3-fluoranyl-4-[(2S)-octan-2-yl]oxy-phenyl]-6-(4-nonylphenyl)pyridazine Openeye Name: 3-[3-fluoro-4-[(1S)-1-methylheptoxy]phenyl]-6-(4-nonylphenyl)pyridazine CAS Name: 3-[3-fluoro-4-[(2S)-octan-2-yl]oxyphenyl]-6-(4-nonylphenyl)pyridazine IUPAC Name: 3-[3-fluoro-4-[(2S)-octan-2-yl]oxyphenyl]-6-(4-nonylphenyl)pyridazine Traditional Name: 3-[3-fluoro-4-[(1S)-1-methylheptoxy]phenyl]-6-(4-nonylphenyl)pyridazine Formula: C33H45FN2O MolecularWeight: 504.721603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=C(C=C1)C2=NN=C(C=C2)C3=CC(=C(C=C3)OC(C)CCCCCC)F

Isomeric SMILES

CCCCCCCCCC1=CC=C(C=C1)C2=NN=C(C=C2)C3=CC(=C(C=C3)O[C@@H](C)CCCCCC)F

InChI

InChI=1S/C33H45FN2O/c1-4-6-8-10-11-12-14-16-27-17-19-28(20-18-27)31-22-23-32(36-35-31)29-21-24-33(30(34)25-29)37-26(3)15-13-9-7-5-2/h17-26H,4-16H2,1-3H3/t26-/m0/s1