(E)-1-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]-3-thiophen-2-yl-prop-2-en-1-one

Systemtic Name: (E)-1-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]-3-thiophen-2-yl-prop-2-en-1-one Openeye Name: (E)-1-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]-3-(2-thienyl)prop-2-en-1-one CAS Name: (E)-1-[(2R)-4-methyl-2-phenyl-1-piperazin-4-iumyl]-3-thiophen-2-yl-2-propen-1-one IUPAC Name: (E)-1-[(2R)-4-methyl-2-phenylpiperazin-4-ium-1-yl]-3-thiophen-2-ylprop-2-en-1-one Traditional Name: (E)-1-[(2R)-4-methyl-2-phenyl-piperazin-4-ium-1-yl]-3-(2-thienyl)prop-2-en-1-one Formula: C18H21N2OS+ MolecularWeight: 313.43714

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)C(=O)C=CC3=CC=CS3

Isomeric SMILES

C[NH+]1CCN([C@@H](C1)C2=CC=CC=C2)C(=O)/C=C/C3=CC=CS3

InChI

InChI=1S/C18H20N2OS/c1-19-11-12-20(17(14-19)15-6-3-2-4-7-15)18(21)10-9-16-8-5-13-22-16/h2-10,13,17H,11-12,14H2,1H3/p+1/b10-9+/t17-/m0/s1