(E)-3-[1-(10-bromanyldecyl)pyridin-1-ium-4-yl]-1-phenyl-prop-2-en-1-one bromide

Systemtic Name: (E)-3-[1-(10-bromanyldecyl)pyridin-1-ium-4-yl]-1-phenyl-prop-2-en-1-one bromide Openeye Name: (E)-3-[1-(10-bromodecyl)pyridin-1-ium-4-yl]-1-phenyl-prop-2-en-1-one bromide CAS Name: (E)-3-[1-(10-bromodecyl)-4-pyridin-1-iumyl]-1-phenyl-2-propen-1-one bromide IUPAC Name: (E)-3-[1-(10-bromodecyl)pyridin-1-ium-4-yl]-1-phenylprop-2-en-1-one bromide Traditional Name: (E)-3-[1-(10-bromodecyl)pyridin-1-ium-4-yl]-1-phenyl-prop-2-en-1-one bromide Formula: C24H31Br2NO MolecularWeight: 509.31704

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C=CC2=CC=[N+](C=C2)CCCCCCCCCCBr.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)/C=C/C2=CC=[N+](C=C2)CCCCCCCCCCBr.[Br-]

InChI

InChI=1S/C24H31BrNO.BrH/c25-18-10-5-3-1-2-4-6-11-19-26-20-16-22(17-21-26)14-15-24(27)23-12-8-7-9-13-23;/h7-9,12-17,20-21H,1-6,10-11,18-19H2;1H/q+1;/p-1/b15-14+;