(E)-1-(2-chloranyl-3,4-dimethoxy-phenyl)-3-(4-cyclohexylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-1-(2-chloranyl-3,4-dimethoxy-phenyl)-3-(4-cyclohexylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(2-chloro-3,4-dimethoxy-phenyl)-3-(4-cyclohexylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-1-(2-chloro-3,4-dimethoxyphenyl)-3-(4-cyclohexyl-1-piperazinyl)-2-propen-1-one IUPAC Name: (E)-1-(2-chloro-3,4-dimethoxyphenyl)-3-(4-cyclohexylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-1-(2-chloro-3,4-dimethoxy-phenyl)-3-(4-cyclohexylpiperazino)prop-2-en-1-one Formula: C21H29ClN2O3 MolecularWeight: 392.91956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(=O)C=CN2CCN(CC2)C3CCCCC3)Cl)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C(=O)/C=C/N2CCN(CC2)C3CCCCC3)Cl)OC

InChI

InChI=1S/C21H29ClN2O3/c1-26-19-9-8-17(20(22)21(19)27-2)18(25)10-11-23-12-14-24(15-13-23)16-6-4-3-5-7-16/h8-11,16H,3-7,12-15H2,1-2H3/b11-10+