8-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-3-(2-methoxyphenyl)-7-oxidanyl-chromen-4-one

Systemtic Name: 8-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-3-(2-methoxyphenyl)-7-oxidanyl-chromen-4-one Openeye Name: 8-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-3-(2-methoxyphenyl)chromen-4-one CAS Name: 8-[[(2S,6S)-2,6-dimethyl-1-piperidin-1-iumyl]methyl]-7-hydroxy-3-(2-methoxyphenyl)-1-benzopyran-4-one IUPAC Name: 8-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-3-(2-methoxyphenyl)chromen-4-one Traditional Name: 8-[[(2S,6S)-2,6-dimethylpiperidin-1-ium-1-yl]methyl]-7-hydroxy-3-(2-methoxyphenyl)chromone Formula: C24H28NO4+ MolecularWeight: 394.48342

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC([NH+]1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4OC)O)C

Isomeric SMILES

C[C@H]1CCC[C@@H]([NH+]1CC2=C(C=CC3=C2OC=C(C3=O)C4=CC=CC=C4OC)O)C

InChI

InChI=1S/C24H27NO4/c1-15-7-6-8-16(2)25(15)13-19-21(26)12-11-18-23(27)20(14-29-24(18)19)17-9-4-5-10-22(17)28-3/h4-5,9-12,14-16,26H,6-8,13H2,1-3H3/p+1/t15-,16-/m0/s1