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

Systemtic Name: N-(3-bromanyl-5-phenyl-pyrazin-2-yl)-4-methyl-N-pyridin-1-ium-1-yl-benzamide Openeye Name: N-(3-bromo-5-phenyl-pyrazin-2-yl)-4-methyl-N-pyridin-1-ium-1-yl-benzamide CAS Name: N-(3-bromo-5-phenyl-2-pyrazinyl)-4-methyl-N-(1-pyridin-1-iumyl)benzamide IUPAC Name: N-(3-bromo-5-phenylpyrazin-2-yl)-4-methyl-N-pyridin-1-ium-1-ylbenzamide Traditional Name: N-(3-bromo-5-phenyl-pyrazin-2-yl)-4-methyl-N-pyridin-1-ium-1-yl-benzamide Formula: C23H18BrN4O+ MolecularWeight: 446.31922

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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=CC=C3)[N+]4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C23H18BrN4O/c1-17-10-12-19(13-11-17)23(29)28(27-14-6-3-7-15-27)22-21(24)26-20(16-25-22)18-8-4-2-5-9-18/h2-16H,1H3/q+1