4-[3-(4-methylphenyl)prop-2-ynyl]-4-prop-2-enyl-morpholin-4-ium bromide

Systemtic Name: 4-[3-(4-methylphenyl)prop-2-ynyl]-4-prop-2-enyl-morpholin-4-ium bromide Openeye Name: 4-allyl-4-[3-(p-tolyl)prop-2-ynyl]morpholin-4-ium bromide CAS Name: 4-[3-(4-methylphenyl)prop-2-ynyl]-4-prop-2-enylmorpholin-4-ium bromide IUPAC Name: 4-[3-(4-methylphenyl)prop-2-ynyl]-4-prop-2-enylmorpholin-4-ium bromide Traditional Name: 4-allyl-4-[3-(p-tolyl)prop-2-ynyl]morpholin-4-ium bromide Formula: C17H22BrNO MolecularWeight: 336.26668

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C#CC[N+]2(CCOCC2)CC=C.[Br-]

Isomeric SMILES

CC1=CC=C(C=C1)C#CC[N+]2(CCOCC2)CC=C.[Br-]

InChI

InChI=1S/C17H22NO.BrH/c1-3-10-18(12-14-19-15-13-18)11-4-5-17-8-6-16(2)7-9-17;/h3,6-9H,1,10-15H2,2H3;1H/q+1;/p-1