(E)-1-(4-butylphenyl)-4-imidazol-1-yl-oct-1-en-3-one

Systemtic Name: (E)-1-(4-butylphenyl)-4-imidazol-1-yl-oct-1-en-3-one Openeye Name: (E)-1-(4-butylphenyl)-4-imidazol-1-yl-oct-1-en-3-one CAS Name: (E)-1-(4-butylphenyl)-4-(1-imidazolyl)-1-octen-3-one IUPAC Name: (E)-1-(4-butylphenyl)-4-imidazol-1-yloct-1-en-3-one Traditional Name: (E)-1-(4-butylphenyl)-4-imidazol-1-yl-oct-1-en-3-one Formula: C21H28N2O MolecularWeight: 324.45982

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C=CC(=O)C(CCCC)N2C=CN=C2

Isomeric SMILES

CCCCC1=CC=C(C=C1)/C=C/C(=O)C(CCCC)N2C=CN=C2

InChI

InChI=1S/C21H28N2O/c1-3-5-7-18-9-11-19(12-10-18)13-14-21(24)20(8-6-4-2)23-16-15-22-17-23/h9-17,20H,3-8H2,1-2H3/b14-13+