3-(3-methoxyphenoxy)-8-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-7-oxidanyl-chromen-4-one

Systemtic Name: 3-(3-methoxyphenoxy)-8-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]-7-oxidanyl-chromen-4-one Openeye Name: 7-hydroxy-3-(3-methoxyphenoxy)-8-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]chromen-4-one CAS Name: 7-hydroxy-3-(3-methoxyphenoxy)-8-[[(2S)-2-methyl-1-piperidin-1-iumyl]methyl]-1-benzopyran-4-one IUPAC Name: 7-hydroxy-3-(3-methoxyphenoxy)-8-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]chromen-4-one Traditional Name: 7-hydroxy-3-(3-methoxyphenoxy)-8-[[(2S)-2-methylpiperidin-1-ium-1-yl]methyl]chromone Formula: C23H26NO5+ MolecularWeight: 396.45624

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC[NH+]1CC2=C(C=CC3=C2OC=C(C3=O)OC4=CC(=CC=C4)OC)O

Isomeric SMILES

C[C@H]1CCCC[NH+]1CC2=C(C=CC3=C2OC=C(C3=O)OC4=CC(=CC=C4)OC)O

InChI

InChI=1S/C23H25NO5/c1-15-6-3-4-11-24(15)13-19-20(25)10-9-18-22(26)21(14-28-23(18)19)29-17-8-5-7-16(12-17)27-2/h5,7-10,12,14-15,25H,3-4,6,11,13H2,1-2H3/p+1/t15-/m0/s1