6-ethyl-8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-3-(4-methyl-1,3-thiazol-2-yl)-7-oxidanyl-chromen-4-one

Systemtic Name: 6-ethyl-8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-3-(4-methyl-1,3-thiazol-2-yl)-7-oxidanyl-chromen-4-one Openeye Name: 6-ethyl-8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-3-(4-methylthiazol-2-yl)chromen-4-one CAS Name: 6-ethyl-8-[[(2R)-2-ethyl-1-piperidin-1-iumyl]methyl]-7-hydroxy-3-(4-methyl-2-thiazolyl)-1-benzopyran-4-one IUPAC Name: 6-ethyl-8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-3-(4-methyl-1,3-thiazol-2-yl)chromen-4-one Traditional Name: 6-ethyl-8-[[(2R)-2-ethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-3-(4-methylthiazol-2-yl)chromone Formula: C23H29N2O3S+ MolecularWeight: 413.55296

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[NH+]1CC2=C3C(=CC(=C2O)CC)C(=O)C(=CO3)C4=NC(=CS4)C

Isomeric SMILES

CC[C@@H]1CCCC[NH+]1CC2=C3C(=CC(=C2O)CC)C(=O)C(=CO3)C4=NC(=CS4)C

InChI

InChI=1S/C23H28N2O3S/c1-4-15-10-17-21(27)19(23-24-14(3)13-29-23)12-28-22(17)18(20(15)26)11-25-9-7-6-8-16(25)5-2/h10,12-13,16,26H,4-9,11H2,1-3H3/p+1/t16-/m1/s1