7-methoxy-4-[[(2R)-2-methylpiperidin-1-ium-1-yl]methyl]chromen-2-one

Systemtic Name: 7-methoxy-4-[[(2R)-2-methylpiperidin-1-ium-1-yl]methyl]chromen-2-one Openeye Name: 7-methoxy-4-[[(2R)-2-methylpiperidin-1-ium-1-yl]methyl]chromen-2-one CAS Name: 7-methoxy-4-[[(2R)-2-methyl-1-piperidin-1-iumyl]methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-[[(2R)-2-methylpiperidin-1-ium-1-yl]methyl]chromen-2-one Traditional Name: 7-methoxy-4-[[(2R)-2-methylpiperidin-1-ium-1-yl]methyl]coumarin Formula: C17H22NO3+ MolecularWeight: 288.36148

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=CC(=O)OC3=C2C=CC(=C3)OC

Isomeric SMILES

C[C@@H]1CCCC[NH+]1CC2=CC(=O)OC3=C2C=CC(=C3)OC

InChI

InChI=1S/C17H21NO3/c1-12-5-3-4-8-18(12)11-13-9-17(19)21-16-10-14(20-2)6-7-15(13)16/h6-7,9-10,12H,3-5,8,11H2,1-2H3/p+1/t12-/m1/s1