(E)-1-(5-bromanyl-2-ethoxy-phenyl)-3-(4-cyclohexylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(5-bromanyl-2-ethoxy-phenyl)-3-(4-cyclohexylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(5-bromo-2-ethoxy-phenyl)-3-(4-cyclohexylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-1-(5-bromo-2-ethoxyphenyl)-3-(4-cyclohexyl-1-piperazinyl)-2-propen-1-one IUPAC Name: (E)-1-(5-bromo-2-ethoxyphenyl)-3-(4-cyclohexylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-1-(5-bromo-2-ethoxy-phenyl)-3-(4-cyclohexylpiperazino)prop-2-en-1-one Formula: C21H29BrN2O2 MolecularWeight: 421.37116

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C(=O)C=CN2CCN(CC2)C3CCCCC3

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C(=O)/C=C/N2CCN(CC2)C3CCCCC3

InChI

InChI=1S/C21H29BrN2O2/c1-2-26-21-9-8-17(22)16-19(21)20(25)10-11-23-12-14-24(15-13-23)18-6-4-3-5-7-18/h8-11,16,18H,2-7,12-15H2,1H3/b11-10+