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

Systemtic Name: (4E)-4-[(cycloheptylamino)methylidene]-5-methyl-2-phenyl-pyrazol-3-one Openeye Name: (4E)-4-[(cycloheptylamino)methylene]-5-methyl-2-phenyl-pyrazol-3-one CAS Name: (4E)-4-[(cycloheptylamino)methylidene]-5-methyl-2-phenyl-3-pyrazolone IUPAC Name: (4E)-4-[(cycloheptylamino)methylidene]-5-methyl-2-phenylpyrazol-3-one Traditional Name: (4E)-4-[(cycloheptylamino)methylene]-5-methyl-2-phenyl-2-pyrazolin-3-one Formula: C18H23N3O MolecularWeight: 297.39472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1=CNC2CCCCCC2)C3=CC=CC=C3

Isomeric SMILES

CC\1=NN(C(=O)/C1=C/NC2CCCCCC2)C3=CC=CC=C3

InChI

InChI=1S/C18H23N3O/c1-14-17(13-19-15-9-5-2-3-6-10-15)18(22)21(20-14)16-11-7-4-8-12-16/h4,7-8,11-13,15,19H,2-3,5-6,9-10H2,1H3/b17-13+