N-[1-(4-but-2-ynoxy-3-oxidanylidene-2-propan-2-ylidene-1-benzofuran-5-yl)piperidin-4-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-(4-but-2-ynoxy-3-oxidanylidene-2-propan-2-ylidene-1-benzofuran-5-yl)piperidin-4-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-(4-but-2-ynoxy-2-isopropylidene-3-oxo-benzofuran-5-yl)-4-piperidyl]-4-fluoro-benzamide CAS Name: N-[1-(4-but-2-ynoxy-3-oxo-2-propan-2-ylidene-5-benzofuranyl)-4-piperidinyl]-4-fluorobenzamide IUPAC Name: N-[1-(4-but-2-ynoxy-3-oxo-2-propan-2-ylidene-1-benzofuran-5-yl)piperidin-4-yl]-4-fluorobenzamide Traditional Name: N-[1-(4-but-2-ynoxy-2-isopropylidene-3-keto-coumaran-5-yl)-4-piperidyl]-4-fluoro-benzamide Formula: C27H27FN2O4 MolecularWeight: 462.512683

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1=C(C=CC2=C1C(=O)C(=C(C)C)O2)N3CCC(CC3)NC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC#CCOC1=C(C=CC2=C1C(=O)C(=C(C)C)O2)N3CCC(CC3)NC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C27H27FN2O4/c1-4-5-16-33-26-21(10-11-22-23(26)24(31)25(34-22)17(2)3)30-14-12-20(13-15-30)29-27(32)18-6-8-19(28)9-7-18/h6-11,20H,12-16H2,1-3H3,(H,29,32)