(E)-1-[3,4-bis(oxidanyl)phenyl]-3-(4-phenethylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-1-[3,4-bis(oxidanyl)phenyl]-3-(4-phenethylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(3,4-dihydroxyphenyl)-3-(4-phenethylpiperazin-1-yl)prop-2-en-1-one CAS Name: (E)-1-(3,4-dihydroxyphenyl)-3-(4-phenethyl-1-piperazinyl)-2-propen-1-one IUPAC Name: (E)-1-(3,4-dihydroxyphenyl)-3-(4-phenethylpiperazin-1-yl)prop-2-en-1-one Traditional Name: (E)-1-(3,4-dihydroxyphenyl)-3-(4-phenethylpiperazino)prop-2-en-1-one Formula: C21H24N2O3 MolecularWeight: 352.42686

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC2=CC=CC=C2)C=CC(=O)C3=CC(=C(C=C3)O)O

Isomeric SMILES

C1CN(CCN1CCC2=CC=CC=C2)/C=C/C(=O)C3=CC(=C(C=C3)O)O

InChI

InChI=1S/C21H24N2O3/c24-19(18-6-7-20(25)21(26)16-18)9-11-23-14-12-22(13-15-23)10-8-17-4-2-1-3-5-17/h1-7,9,11,16,25-26H,8,10,12-15H2/b11-9+