6-(2-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-4-(4-phenylpiperazin-1-yl)pyran-3-carbonitrile

Systemtic Name: 6-(2-fluoranyl-4-methoxy-phenyl)-2-oxidanylidene-4-(4-phenylpiperazin-1-yl)pyran-3-carbonitrile Openeye Name: 6-(2-fluoro-4-methoxy-phenyl)-2-oxo-4-(4-phenylpiperazin-1-yl)pyran-3-carbonitrile CAS Name: 6-(2-fluoro-4-methoxyphenyl)-2-oxo-4-(4-phenyl-1-piperazinyl)-3-pyrancarbonitrile IUPAC Name: 6-(2-fluoro-4-methoxyphenyl)-2-oxo-4-(4-phenylpiperazin-1-yl)pyran-3-carbonitrile Traditional Name: 6-(2-fluoro-4-methoxy-phenyl)-2-keto-4-(4-phenylpiperazino)pyran-3-carbonitrile Formula: C23H20FN3O3 MolecularWeight: 405.421603

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CC(=C(C(=O)O2)C#N)N3CCN(CC3)C4=CC=CC=C4)F

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CC(=C(C(=O)O2)C#N)N3CCN(CC3)C4=CC=CC=C4)F

InChI

InChI=1S/C23H20FN3O3/c1-29-17-7-8-18(20(24)13-17)22-14-21(19(15-25)23(28)30-22)27-11-9-26(10-12-27)16-5-3-2-4-6-16/h2-8,13-14H,9-12H2,1H3