6-chloranyl-4-[(2,3-dimethylpyridin-1-ium-1-yl)methyl]-7-methyl-chromen-2-one

Systemtic Name: 6-chloranyl-4-[(2,3-dimethylpyridin-1-ium-1-yl)methyl]-7-methyl-chromen-2-one Openeye Name: 6-chloro-4-[(2,3-dimethylpyridin-1-ium-1-yl)methyl]-7-methyl-chromen-2-one CAS Name: 6-chloro-4-[(2,3-dimethyl-1-pyridin-1-iumyl)methyl]-7-methyl-1-benzopyran-2-one IUPAC Name: 6-chloro-4-[(2,3-dimethylpyridin-1-ium-1-yl)methyl]-7-methylchromen-2-one Traditional Name: 6-chloro-4-[(2,3-dimethylpyridin-1-ium-1-yl)methyl]-7-methyl-coumarin Formula: C18H17ClNO2+ MolecularWeight: 314.78608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=CC=C1)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)C)C

Isomeric SMILES

CC1=C([N+](=CC=C1)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)C)C

InChI

InChI=1S/C18H17ClNO2/c1-11-5-4-6-20(13(11)3)10-14-8-18(21)22-17-7-12(2)16(19)9-15(14)17/h4-9H,10H2,1-3H3/q+1