(E)-3-(2-ethoxy-3-methoxy-phenyl)-1-piperazin-4-ium-1-yl-prop-2-en-1-one

Systemtic Name: (E)-3-(2-ethoxy-3-methoxy-phenyl)-1-piperazin-4-ium-1-yl-prop-2-en-1-one Openeye Name: (E)-3-(2-ethoxy-3-methoxy-phenyl)-1-piperazin-4-ium-1-yl-prop-2-en-1-one CAS Name: (E)-3-(2-ethoxy-3-methoxyphenyl)-1-(1-piperazin-4-iumyl)-2-propen-1-one IUPAC Name: (E)-3-(2-ethoxy-3-methoxyphenyl)-1-piperazin-4-ium-1-ylprop-2-en-1-one Traditional Name: (E)-3-(2-ethoxy-3-methoxy-phenyl)-1-piperazin-4-ium-1-yl-prop-2-en-1-one Formula: C16H23N2O3+ MolecularWeight: 291.36542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=C1OC)C=CC(=O)N2CC[NH2+]CC2

Isomeric SMILES

CCOC1=C(C=CC=C1OC)/C=C/C(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C16H22N2O3/c1-3-21-16-13(5-4-6-14(16)20-2)7-8-15(19)18-11-9-17-10-12-18/h4-8,17H,3,9-12H2,1-2H3/p+1/b8-7+