4-bromanyl-N-[1-[[(2E)-3-oxidanylidene-4-phenylmethoxy-2-[(E)-3-phenylprop-2-enylidene]-1-benzofuran-5-yl]methyl]piperidin-4-yl]benzamide

Systemtic Name: 4-bromanyl-N-[1-[[(2E)-3-oxidanylidene-4-phenylmethoxy-2-[(E)-3-phenylprop-2-enylidene]-1-benzofuran-5-yl]methyl]piperidin-4-yl]benzamide Openeye Name: N-[1-[[(2E)-4-benzyloxy-3-oxo-2-[(E)-3-phenylprop-2-enylidene]benzofuran-5-yl]methyl]-4-piperidyl]-4-bromo-benzamide CAS Name: 4-bromo-N-[1-[[(2E)-3-oxo-4-phenylmethoxy-2-[(E)-3-phenylprop-2-enylidene]-5-benzofuranyl]methyl]-4-piperidinyl]benzamide IUPAC Name: 4-bromo-N-[1-[[(2E)-3-oxo-4-phenylmethoxy-2-[(E)-3-phenylprop-2-enylidene]-1-benzofuran-5-yl]methyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[[(2E)-4-benzoxy-3-keto-2-[(E)-3-phenylprop-2-enylidene]coumaran-5-yl]methyl]-4-piperidyl]-4-bromo-benzamide Formula: C37H33BrN2O4 MolecularWeight: 649.57292

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=C(C=C2)Br)CC3=C(C4=C(C=C3)OC(=CC=CC5=CC=CC=C5)C4=O)OCC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=C(C=C2)Br)CC3=C(C4=C(C=C3)O/C(=C/C=C/C5=CC=CC=C5)/C4=O)OCC6=CC=CC=C6

InChI

InChI=1S/C37H33BrN2O4/c38-30-17-14-28(15-18-30)37(42)39-31-20-22-40(23-21-31)24-29-16-19-32-34(36(29)43-25-27-10-5-2-6-11-27)35(41)33(44-32)13-7-12-26-8-3-1-4-9-26/h1-19,31H,20-25H2,(H,39,42)/b12-7+,33-13+