N-[1-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]pyridin-1-ium-3-yl]benzamide bromide

Systemtic Name: N-[1-[2-oxidanylidene-2-(2-oxidanylidenechromen-3-yl)ethyl]pyridin-1-ium-3-yl]benzamide bromide Openeye Name: N-[1-[2-oxo-2-(2-oxochromen-3-yl)ethyl]pyridin-1-ium-3-yl]benzamide bromide CAS Name: N-[1-[2-oxo-2-(2-oxo-1-benzopyran-3-yl)ethyl]-3-pyridin-1-iumyl]benzamide bromide IUPAC Name: N-[1-[2-oxo-2-(2-oxochromen-3-yl)ethyl]pyridin-1-ium-3-yl]benzamide bromide Traditional Name: N-[1-[2-keto-2-(2-ketochromen-3-yl)ethyl]pyridin-1-ium-3-yl]benzamide bromide Formula: C23H17BrN2O4 MolecularWeight: 465.29608

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C[N+](=CC=C2)CC(=O)C3=CC4=CC=CC=C4OC3=O.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C[N+](=CC=C2)CC(=O)C3=CC4=CC=CC=C4OC3=O.[Br-]

InChI

InChI=1S/C23H16N2O4.BrH/c26-20(19-13-17-9-4-5-11-21(17)29-23(19)28)15-25-12-6-10-18(14-25)24-22(27)16-7-2-1-3-8-16;/h1-14H,15H2;1H