(5E)-2-cyclopentyl-5-[[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]methylidene]cyclopentan-1-one

Systemtic Name: (5E)-2-cyclopentyl-5-[[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]methylidene]cyclopentan-1-one Openeye Name: (5E)-2-cyclopentyl-5-[[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]methylene]cyclopentanone CAS Name: (5E)-2-cyclopentyl-5-[[4-methoxy-3-(1-pyrazolylmethyl)phenyl]methylidene]-1-cyclopentanone IUPAC Name: (5E)-2-cyclopentyl-5-[[4-methoxy-3-(pyrazol-1-ylmethyl)phenyl]methylidene]cyclopentan-1-one Traditional Name: (5E)-2-cyclopentyl-5-[4-methoxy-3-(pyrazol-1-ylmethyl)benzylidene]cyclopentanone Formula: C22H26N2O2 MolecularWeight: 350.45404

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=C2CCC(C2=O)C3CCCC3)CN4C=CC=N4

Isomeric SMILES

COC1=C(C=C(C=C1)/C=C/2\CCC(C2=O)C3CCCC3)CN4C=CC=N4

InChI

InChI=1S/C22H26N2O2/c1-26-21-10-7-16(14-19(21)15-24-12-4-11-23-24)13-18-8-9-20(22(18)25)17-5-2-3-6-17/h4,7,10-14,17,20H,2-3,5-6,8-9,15H2,1H3/b18-13+