(4E)-4-[(cyclohexylamino)methylidene]-5-methyl-2-phenyl-pyrazol-3-one

Systemtic Name: (4E)-4-[(cyclohexylamino)methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[(cyclohexylamino)methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[(cyclohexylamino)methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[(cyclohexylamino)methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[(cyclohexylamino)methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C17H21N3O MolecularWeight: 283.36814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC2CCCCC2)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/NC2CCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C17H21N3O/c1-13-16(12-18-14-8-4-2-5-9-14)17(21)20(19-13)15-10-6-3-7-11-15/h3,6-7,10-12,14,18H,2,4-5,8-9H2,1H3/b16-12+