(3E)-6-bromanyl-3-[1-(2-methoxy-2-phenyl-ethanoyl)-5-phenyl-pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one

Systemtic Name: (3E)-6-bromanyl-3-[1-(2-methoxy-2-phenyl-ethanoyl)-5-phenyl-pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one Openeye Name: (3E)-6-bromo-3-[1-(2-methoxy-2-phenyl-acetyl)-5-phenyl-pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one CAS Name: (3E)-6-bromo-3-[1-(2-methoxy-1-oxo-2-phenylethyl)-5-phenyl-3-pyrazolidinylidene]-4-phenyl-2-quinolinone IUPAC Name: (3E)-6-bromo-3-[1-(2-methoxy-2-phenylacetyl)-5-phenylpyrazolidin-3-ylidene]-4-phenylquinolin-2-one Traditional Name: (3E)-6-bromo-3-[1-(2-methoxy-2-phenyl-acetyl)-5-phenyl-pyrazolidin-3-ylidene]-4-phenyl-carbostyril Formula: C33H26BrN3O3 MolecularWeight: 592.48184

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Descriptors Computed from Structure

Canonical SMILES:

COC(C1=CC=CC=C1)C(=O)N2C(CC(=C3C(=C4C=C(C=CC4=NC3=O)Br)C5=CC=CC=C5)N2)C6=CC=CC=C6

Isomeric SMILES

COC(C1=CC=CC=C1)C(=O)N2C(C/C(=C\3/C(=C4C=C(C=CC4=NC3=O)Br)C5=CC=CC=C5)/N2)C6=CC=CC=C6

InChI

InChI=1S/C33H26BrN3O3/c1-40-31(23-15-9-4-10-16-23)33(39)37-28(21-11-5-2-6-12-21)20-27(36-37)30-29(22-13-7-3-8-14-22)25-19-24(34)17-18-26(25)35-32(30)38/h2-19,28,31,36H,20H2,1H3/b30-27+