(4Z)-4-[[3-(3-chloranyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-2,5-diphenyl-pyrazol-3-one

Systemtic Name: (4Z)-4-[[3-(3-chloranyl-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylidene]-2,5-diphenyl-pyrazol-3-one Openeye Name: (4Z)-4-[[3-(3-chloro-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-2,5-diphenyl-pyrazol-3-one CAS Name: (4Z)-4-[[3-(3-chloro-4-propoxyphenyl)-1-phenyl-4-pyrazolyl]methylidene]-2,5-diphenyl-3-pyrazolone IUPAC Name: (4Z)-4-[[3-(3-chloro-4-propoxyphenyl)-1-phenylpyrazol-4-yl]methylidene]-2,5-diphenylpyrazol-3-one Traditional Name: (4Z)-4-[[3-(3-chloro-4-propoxy-phenyl)-1-phenyl-pyrazol-4-yl]methylene]-2,5-diphenyl-2-pyrazolin-3-one Formula: C34H27ClN4O2 MolecularWeight: 559.05678

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C2=NN(C=C2C=C3C(=NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)Cl

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C2=NN(C=C2/C=C\3/C(=NN(C3=O)C4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6)Cl

InChI

InChI=1S/C34H27ClN4O2/c1-2-20-41-31-19-18-25(22-30(31)35)32-26(23-38(36-32)27-14-8-4-9-15-27)21-29-33(24-12-6-3-7-13-24)37-39(34(29)40)28-16-10-5-11-17-28/h3-19,21-23H,2,20H2,1H3/b29-21-