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

Systemtic Name: 8-(1-methyl-3-oxidanyl-piperidin-4-yl)-2-(3-nitrophenyl)-5,7-bis(oxidanyl)chromen-4-one Openeye Name: 5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidyl)-2-(3-nitrophenyl)chromen-4-one CAS Name: 5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidinyl)-2-(3-nitrophenyl)-1-benzopyran-4-one IUPAC Name: 5,7-dihydroxy-8-(3-hydroxy-1-methylpiperidin-4-yl)-2-(3-nitrophenyl)chromen-4-one Traditional Name: 5,7-dihydroxy-8-(3-hydroxy-1-methyl-4-piperidyl)-2-(3-nitrophenyl)chromone Formula: C21H20N2O7 MolecularWeight: 412.3927

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C(C1)O)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC(=CC=C4)[N+](=O)[O-])O)O

Isomeric SMILES

CN1CCC(C(C1)O)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC(=CC=C4)[N+](=O)[O-])O)O

InChI

InChI=1S/C21H20N2O7/c1-22-6-5-13(17(27)10-22)19-14(24)8-15(25)20-16(26)9-18(30-21(19)20)11-3-2-4-12(7-11)23(28)29/h2-4,7-9,13,17,24-25,27H,5-6,10H2,1H3