(Z)-3-(3-bromanyl-4-methoxy-phenyl)-1-(4-ethylpiperazin-4-ium-1-yl)prop-2-en-1-one

Systemtic Name: (Z)-3-(3-bromanyl-4-methoxy-phenyl)-1-(4-ethylpiperazin-4-ium-1-yl)prop-2-en-1-one Openeye Name: (Z)-3-(3-bromo-4-methoxy-phenyl)-1-(4-ethylpiperazin-4-ium-1-yl)prop-2-en-1-one CAS Name: (Z)-3-(3-bromo-4-methoxyphenyl)-1-(4-ethyl-1-piperazin-4-iumyl)-2-propen-1-one IUPAC Name: (Z)-3-(3-bromo-4-methoxyphenyl)-1-(4-ethylpiperazin-4-ium-1-yl)prop-2-en-1-one Traditional Name: (Z)-3-(3-bromo-4-methoxy-phenyl)-1-(4-ethylpiperazin-4-ium-1-yl)prop-2-en-1-one Formula: C16H22BrN2O2+ MolecularWeight: 354.26208

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C=CC2=CC(=C(C=C2)OC)Br

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)/C=C\C2=CC(=C(C=C2)OC)Br

InChI

InChI=1S/C16H21BrN2O2/c1-3-18-8-10-19(11-9-18)16(20)7-5-13-4-6-15(21-2)14(17)12-13/h4-7,12H,3,8-11H2,1-2H3/p+1/b7-5-