7-[3-(4-ethanoyl-6-nitro-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]-8-methyl-3-nitro-2-oxidanyl-chromen-4-one

Systemtic Name: 7-[3-(4-ethanoyl-6-nitro-3-oxidanyl-2-propyl-phenoxy)-2-oxidanyl-propoxy]-8-methyl-3-nitro-2-oxidanyl-chromen-4-one Openeye Name: 7-[3-(4-acetyl-3-hydroxy-6-nitro-2-propyl-phenoxy)-2-hydroxy-propoxy]-2-hydroxy-8-methyl-3-nitro-chromen-4-one CAS Name: 7-[3-(4-acetyl-3-hydroxy-6-nitro-2-propylphenoxy)-2-hydroxypropoxy]-2-hydroxy-8-methyl-3-nitro-1-benzopyran-4-one IUPAC Name: 7-[3-(4-acetyl-3-hydroxy-6-nitro-2-propylphenoxy)-2-hydroxypropoxy]-2-hydroxy-8-methyl-3-nitrochromen-4-one Traditional Name: 7-[3-(4-acetyl-3-hydroxy-6-nitro-2-propyl-phenoxy)-2-hydroxy-propoxy]-2-hydroxy-8-methyl-3-nitro-chromone Formula: C24H24N2O12 MolecularWeight: 532.45356

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=CC(=C1OCC(COC2=C(C3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-])C)O)[N+](=O)[O-])C(=O)C)O

Isomeric SMILES

CCCC1=C(C(=CC(=C1OCC(COC2=C(C3=C(C=C2)C(=O)C(=C(O3)O)[N+](=O)[O-])C)O)[N+](=O)[O-])C(=O)C)O

InChI

InChI=1S/C24H24N2O12/c1-4-5-14-20(29)16(12(3)27)8-17(25(32)33)23(14)37-10-13(28)9-36-18-7-6-15-21(30)19(26(34)35)24(31)38-22(15)11(18)2/h6-8,13,28-29,31H,4-5,9-10H2,1-3H3