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

Systemtic Name: (3E)-6-bromanyl-4-phenyl-3-(5-phenyl-1-propanoyl-pyrazolidin-3-ylidene)quinolin-2-one Openeye Name: (3E)-6-bromo-4-phenyl-3-(5-phenyl-1-propanoyl-pyrazolidin-3-ylidene)quinolin-2-one CAS Name: (3E)-6-bromo-3-[1-(1-oxopropyl)-5-phenyl-3-pyrazolidinylidene]-4-phenyl-2-quinolinone IUPAC Name: (3E)-6-bromo-4-phenyl-3-(5-phenyl-1-propanoylpyrazolidin-3-ylidene)quinolin-2-one Traditional Name: (3E)-6-bromo-4-phenyl-3-(5-phenyl-1-propionyl-pyrazolidin-3-ylidene)carbostyril Formula: C27H22BrN3O2 MolecularWeight: 500.38648

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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

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

InChI

InChI=1S/C27H22BrN3O2/c1-2-24(32)31-23(17-9-5-3-6-10-17)16-22(30-31)26-25(18-11-7-4-8-12-18)20-15-19(28)13-14-21(20)29-27(26)33/h3-15,23,30H,2,16H2,1H3/b26-22+