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

Systemtic Name: 3-(4-methoxyphenoxy)-2-methyl-8-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]-7-oxidanyl-chromen-4-one Openeye Name: 7-hydroxy-3-(4-methoxyphenoxy)-2-methyl-8-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]chromen-4-one CAS Name: 7-hydroxy-3-(4-methoxyphenoxy)-2-methyl-8-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]-1-benzopyran-4-one IUPAC Name: 7-hydroxy-3-(4-methoxyphenoxy)-2-methyl-8-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]chromen-4-one Traditional Name: 7-hydroxy-3-(4-methoxyphenoxy)-2-methyl-8-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]chromone Formula: C24H28NO5+ MolecularWeight: 410.48282

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=C(C=CC3=C2OC(=C(C3=O)OC4=CC=C(C=C4)OC)C)O

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=C(C=CC3=C2OC(=C(C3=O)OC4=CC=C(C=C4)OC)C)O

InChI

InChI=1S/C24H27NO5/c1-15-5-4-12-25(13-15)14-20-21(26)11-10-19-22(27)23(16(2)29-24(19)20)30-18-8-6-17(28-3)7-9-18/h6-11,15,26H,4-5,12-14H2,1-3H3/p+1/t15-/m0/s1