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

Systemtic Name: (3E)-6-bromanyl-3-[5-(3-nitrophenyl)-1-propanoyl-pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one Openeye Name: (3E)-6-bromo-3-[5-(3-nitrophenyl)-1-propanoyl-pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one CAS Name: (3E)-6-bromo-3-[5-(3-nitrophenyl)-1-(1-oxopropyl)-3-pyrazolidinylidene]-4-phenyl-2-quinolinone IUPAC Name: (3E)-6-bromo-3-[5-(3-nitrophenyl)-1-propanoylpyrazolidin-3-ylidene]-4-phenylquinolin-2-one Traditional Name: (3E)-6-bromo-3-[5-(3-nitrophenyl)-1-propionyl-pyrazolidin-3-ylidene]-4-phenyl-carbostyril Formula: C27H21BrN4O4 MolecularWeight: 545.38404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(CC(=C2C(=C3C=C(C=CC3=NC2=O)Br)C4=CC=CC=C4)N1)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)N1C(C/C(=C\2/C(=C3C=C(C=CC3=NC2=O)Br)C4=CC=CC=C4)/N1)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H21BrN4O4/c1-2-24(33)31-23(17-9-6-10-19(13-17)32(35)36)15-22(30-31)26-25(16-7-4-3-5-8-16)20-14-18(28)11-12-21(20)29-27(26)34/h3-14,23,30H,2,15H2,1H3/b26-22+