6-bromanyl-3-[2-(4-methylpyridin-1-ium-1-yl)ethanoyl]chromen-2-one

Systemtic Name: 6-bromanyl-3-[2-(4-methylpyridin-1-ium-1-yl)ethanoyl]chromen-2-one Openeye Name: 6-bromo-3-[2-(4-methylpyridin-1-ium-1-yl)acetyl]chromen-2-one CAS Name: 6-bromo-3-[2-(4-methyl-1-pyridin-1-iumyl)-1-oxoethyl]-1-benzopyran-2-one IUPAC Name: 6-bromo-3-[2-(4-methylpyridin-1-ium-1-yl)acetyl]chromen-2-one Traditional Name: 6-bromo-3-[2-(4-methylpyridin-1-ium-1-yl)acetyl]coumarin Formula: C17H13BrNO3+ MolecularWeight: 359.19402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)CC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O

Isomeric SMILES

CC1=CC=[N+](C=C1)CC(=O)C2=CC3=C(C=CC(=C3)Br)OC2=O

InChI

InChI=1S/C17H13BrNO3/c1-11-4-6-19(7-5-11)10-15(20)14-9-12-8-13(18)2-3-16(12)22-17(14)21/h2-9H,10H2,1H3/q+1