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dimethyl-[2-[4-[(E)-3-oxidanylidene-3-piperazin-4-ium-1-yl-prop-1-enyl]phenoxy]ethyl]azanium

dimethyl-[2-[4-[(E)-3-oxidanylidene-3-piperazin-4-ium-1-yl-prop-1-enyl]phenoxy]ethyl]azanium

Systemtic Name:dimethyl-[2-[4-[(E)-3-oxidanylidene-3-piperazin-4-ium-1-yl-prop-1-enyl]phenoxy]ethyl]azanium
Openeye Name:dimethyl-[2-[4-[(E)-3-oxo-3-piperazin-4-ium-1-yl-prop-1-enyl]phenoxy]ethyl]ammonium
CAS Name:dimethyl-[2-[4-[(E)-3-oxo-3-(1-piperazin-4-iumyl)prop-1-enyl]phenoxy]ethyl]ammonium
IUPAC Name:dimethyl-[2-[4-[(E)-3-oxo-3-piperazin-4-ium-1-ylprop-1-enyl]phenoxy]ethyl]azanium
Traditional Name:2-[4-[(E)-3-keto-3-piperazin-4-ium-1-yl-prop-1-enyl]phenoxy]ethyl-dimethyl-ammonium
Formula: C17H27N3O2+2
MolecularWeight: 305.41518
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCOC1=CC=C(C=C1)C=CC(=O)N2CC[NH2+]CC2


Isomeric SMILES

C[NH+](C)CCOC1=CC=C(C=C1)/C=C/C(=O)N2CC[NH2+]CC2


InChI

InChI=1S/C17H25N3O2/c1-19(2)13-14-22-16-6-3-15(4-7-16)5-8-17(21)20-11-9-18-10-12-20/h3-8,18H,9-14H2,1-2H3/p+2/b8-5+


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