(E)-1-piperazin-4-ium-1-yl-3-(2-propoxyphenyl)prop-2-en-1-one

Systemtic Name: (E)-1-piperazin-4-ium-1-yl-3-(2-propoxyphenyl)prop-2-en-1-one Openeye Name: (E)-1-piperazin-4-ium-1-yl-3-(2-propoxyphenyl)prop-2-en-1-one CAS Name: (E)-1-(1-piperazin-4-iumyl)-3-(2-propoxyphenyl)-2-propen-1-one IUPAC Name: (E)-1-piperazin-4-ium-1-yl-3-(2-propoxyphenyl)prop-2-en-1-one Traditional Name: (E)-1-piperazin-4-ium-1-yl-3-(2-propoxyphenyl)prop-2-en-1-one Formula: C16H23N2O2+ MolecularWeight: 275.36602

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C=CC(=O)N2CC[NH2+]CC2

Isomeric SMILES

CCCOC1=CC=CC=C1/C=C/C(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C16H22N2O2/c1-2-13-20-15-6-4-3-5-14(15)7-8-16(19)18-11-9-17-10-12-18/h3-8,17H,2,9-13H2,1H3/p+1/b8-7+