6-chloranyl-3-[(5S)-1-(3-ethylpentanoyl)-5-(furan-2-yl)pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one

Systemtic Name: 6-chloranyl-3-[(5S)-1-(3-ethylpentanoyl)-5-(furan-2-yl)pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one Openeye Name: 6-chloro-3-[(5S)-1-(3-ethylpentanoyl)-5-(2-furyl)pyrazolidin-3-ylidene]-4-phenyl-quinolin-2-one CAS Name: 6-chloro-3-[(5S)-1-(3-ethyl-1-oxopentyl)-5-(2-furanyl)-3-pyrazolidinylidene]-4-phenyl-2-quinolinone IUPAC Name: 6-chloro-3-[(5S)-1-(3-ethylpentanoyl)-5-(furan-2-yl)pyrazolidin-3-ylidene]-4-phenylquinolin-2-one Traditional Name: 6-chloro-3-[(5S)-1-(3-ethylpentanoyl)-5-(2-furyl)pyrazolidin-3-ylidene]-4-phenyl-carbostyril Formula: C29H28ClN3O3 MolecularWeight: 502.00392

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)CC(=O)N1C(CC(=C2C(=C3C=C(C=CC3=NC2=O)Cl)C4=CC=CC=C4)N1)C5=CC=CO5

Isomeric SMILES

CCC(CC)CC(=O)N1[C@@H](CC(=C2C(=C3C=C(C=CC3=NC2=O)Cl)C4=CC=CC=C4)N1)C5=CC=CO5

InChI

InChI=1S/C29H28ClN3O3/c1-3-18(4-2)15-26(34)33-24(25-11-8-14-36-25)17-23(32-33)28-27(19-9-6-5-7-10-19)21-16-20(30)12-13-22(21)31-29(28)35/h5-14,16,18,24,32H,3-4,15,17H2,1-2H3/t24-/m0/s1