(4E)-4-[[1-[(4-chlorophenyl)methyl]indol-3-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[[1-[(4-chlorophenyl)methyl]indol-3-yl]methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[[1-[(4-chlorophenyl)methyl]indol-3-yl]methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[[1-[(4-chlorophenyl)methyl]-3-indolyl]methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[[1-[(4-chlorophenyl)methyl]indol-3-yl]methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[[1-(4-chlorobenzyl)indol-3-yl]methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C26H20ClN3O MolecularWeight: 425.9095

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CC2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/C2=CN(C3=CC=CC=C32)CC4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C26H20ClN3O/c1-18-24(26(31)30(28-18)22-7-3-2-4-8-22)15-20-17-29(25-10-6-5-9-23(20)25)16-19-11-13-21(27)14-12-19/h2-15,17H,16H2,1H3/b24-15+