4-[(cyclohexylamino)methylidene]-5-methylidene-2-phenyl-pyrazolidin-3-one

Systemtic Name: 4-[(cyclohexylamino)methylidene]-5-methylidene-2-phenyl-pyrazolidin-3-one Openeye Name: 4-[(cyclohexylamino)methylene]-5-methylene-2-phenyl-pyrazolidin-3-one CAS Name: 4-[(cyclohexylamino)methylidene]-5-methylene-2-phenyl-3-pyrazolidinone IUPAC Name: 4-[(cyclohexylamino)methylidene]-5-methylidene-2-phenylpyrazolidin-3-one Traditional Name: 4-[(cyclohexylamino)methylene]-5-methylene-2-phenyl-pyrazolidin-3-one Formula: C17H21N3O MolecularWeight: 283.36814

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=C1C(=CNC2CCCCC2)C(=O)N(N1)C3=CC=CC=C3

Isomeric SMILES

C=C1C(=CNC2CCCCC2)C(=O)N(N1)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/h3,6-7,10-12,14,18-19H,1-2,4-5,8-9H2