4-bromanyl-N-[1-[4-[(3-oxidanylidene-2-propan-2-ylidene-1-benzofuran-4-yl)oxy]but-2-ynyl]piperidin-4-yl]benzamide

Systemtic Name: 4-bromanyl-N-[1-[4-[(3-oxidanylidene-2-propan-2-ylidene-1-benzofuran-4-yl)oxy]but-2-ynyl]piperidin-4-yl]benzamide Openeye Name: 4-bromo-N-[1-[4-(2-isopropylidene-3-oxo-benzofuran-4-yl)oxybut-2-ynyl]-4-piperidyl]benzamide CAS Name: 4-bromo-N-[1-[4-[(3-oxo-2-propan-2-ylidene-4-benzofuranyl)oxy]but-2-ynyl]-4-piperidinyl]benzamide IUPAC Name: 4-bromo-N-[1-[4-[(3-oxo-2-propan-2-ylidene-1-benzofuran-4-yl)oxy]but-2-ynyl]piperidin-4-yl]benzamide Traditional Name: 4-bromo-N-[1-[4-(2-isopropylidene-3-keto-coumaran-4-yl)oxybut-2-ynyl]-4-piperidyl]benzamide Formula: C27H27BrN2O4 MolecularWeight: 523.41828

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C(=O)C2=C(O1)C=CC=C2OCC#CCN3CCC(CC3)NC(=O)C4=CC=C(C=C4)Br)C

Isomeric SMILES

CC(=C1C(=O)C2=C(O1)C=CC=C2OCC#CCN3CCC(CC3)NC(=O)C4=CC=C(C=C4)Br)C

InChI

InChI=1S/C27H27BrN2O4/c1-18(2)26-25(31)24-22(6-5-7-23(24)34-26)33-17-4-3-14-30-15-12-21(13-16-30)29-27(32)19-8-10-20(28)11-9-19/h5-11,21H,12-17H2,1-2H3,(H,29,32)