6-ethyl-8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-4-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 6-ethyl-8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-4-methyl-7-oxidanyl-chromen-2-one Openeye Name: 6-ethyl-8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-4-methyl-chromen-2-one CAS Name: 6-ethyl-8-[[(2R)-2-ethyl-1-piperidin-1-iumyl]methyl]-7-hydroxy-4-methyl-1-benzopyran-2-one IUPAC Name: 6-ethyl-8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-4-methylchromen-2-one Traditional Name: 6-ethyl-8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-4-methyl-coumarin Formula: C20H28NO3+ MolecularWeight: 330.44122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=C3C(=CC(=C2O)CC)C(=CC(=O)O3)C

Isomeric SMILES

CC[C@@H]1CCCC[NH+]1CC2=C3C(=CC(=C2O)CC)C(=CC(=O)O3)C

InChI

InChI=1S/C20H27NO3/c1-4-14-11-16-13(3)10-18(22)24-20(16)17(19(14)23)12-21-9-7-6-8-15(21)5-2/h10-11,15,23H,4-9,12H2,1-3H3/p+1/t15-/m1/s1