2-isoquinolin-3-yl-8-(1-methyl-3-oxidanyl-piperidin-4-yl)-5,7-bis(oxidanyl)chromen-4-one

Systemtic Name: 2-isoquinolin-3-yl-8-(1-methyl-3-oxidanyl-piperidin-4-yl)-5,7-bis(oxidanyl)chromen-4-one Openeye Name: 5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidyl)-2-(3-isoquinolyl)chromen-4-one CAS Name: 5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidinyl)-2-(3-isoquinolinyl)-1-benzopyran-4-one IUPAC Name: 5,7-dihydroxy-8-(3-hydroxy-1-methylpiperidin-4-yl)-2-isoquinolin-3-ylchromen-4-one Traditional Name: 5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidyl)-2-(3-isoquinolyl)chromone Formula: C24H22N2O5 MolecularWeight: 418.44188

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1)O)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC5=CC=CC=C5C=N4)O)O

Isomeric SMILES

CN1CCC(C(C1)O)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC5=CC=CC=C5C=N4)O)O

InChI

InChI=1S/C24H22N2O5/c1-26-7-6-15(20(30)12-26)22-17(27)9-18(28)23-19(29)10-21(31-24(22)23)16-8-13-4-2-3-5-14(13)11-25-16/h2-5,8-11,15,20,27-28,30H,6-7,12H2,1H3