N-[3-bromanyl-5-(4-methoxyphenyl)pyrazin-2-yl]-4-methyl-N-pyridin-1-ium-1-yl-benzamide

Systemtic Name: N-[3-bromanyl-5-(4-methoxyphenyl)pyrazin-2-yl]-4-methyl-N-pyridin-1-ium-1-yl-benzamide Openeye Name: N-[3-bromo-5-(4-methoxyphenyl)pyrazin-2-yl]-4-methyl-N-pyridin-1-ium-1-yl-benzamide CAS Name: N-[3-bromo-5-(4-methoxyphenyl)-2-pyrazinyl]-4-methyl-N-(1-pyridin-1-iumyl)benzamide IUPAC Name: N-[3-bromo-5-(4-methoxyphenyl)pyrazin-2-yl]-4-methyl-N-pyridin-1-ium-1-ylbenzamide Traditional Name: N-[3-bromo-5-(4-methoxyphenyl)pyrazin-2-yl]-4-methyl-N-pyridin-1-ium-1-yl-benzamide Formula: C24H20BrN4O2+ MolecularWeight: 476.3452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N(C2=NC=C(N=C2Br)C3=CC=C(C=C3)OC)[N+]4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N(C2=NC=C(N=C2Br)C3=CC=C(C=C3)OC)[N+]4=CC=CC=C4

InChI

InChI=1S/C24H20BrN4O2/c1-17-6-8-19(9-7-17)24(30)29(28-14-4-3-5-15-28)23-22(25)27-21(16-26-23)18-10-12-20(31-2)13-11-18/h3-16H,1-2H3/q+1