3-[2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanoyl]chromen-2-one

Systemtic Name: 3-[2-[4-(dimethylamino)pyridin-1-ium-1-yl]ethanoyl]chromen-2-one Openeye Name: 3-[2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetyl]chromen-2-one CAS Name: 3-[2-[4-(dimethylamino)-1-pyridin-1-iumyl]-1-oxoethyl]-1-benzopyran-2-one IUPAC Name: 3-[2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetyl]chromen-2-one Traditional Name: 3-[2-[4-(dimethylamino)pyridin-1-ium-1-yl]acetyl]coumarin Formula: C18H17N2O3+ MolecularWeight: 309.33918

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=[N+](C=C1)CC(=O)C2=CC3=CC=CC=C3OC2=O

Isomeric SMILES

CN(C)C1=CC=[N+](C=C1)CC(=O)C2=CC3=CC=CC=C3OC2=O

InChI

InChI=1S/C18H17N2O3/c1-19(2)14-7-9-20(10-8-14)12-16(21)15-11-13-5-3-4-6-17(13)23-18(15)22/h3-11H,12H2,1-2H3/q+1