2-(2-bromanyl-5-nitro-phenyl)-8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-5,7-dimethoxy-chromen-4-one

Systemtic Name: 2-(2-bromanyl-5-nitro-phenyl)-8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-5,7-dimethoxy-chromen-4-one Openeye Name: 2-(2-bromo-5-nitro-phenyl)-8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-5,7-dimethoxy-chromen-4-one CAS Name: 2-(2-bromo-5-nitrophenyl)-8-[2-(hydroxymethyl)-1-methyl-3-pyrrolidinyl]-5,7-dimethoxy-1-benzopyran-4-one IUPAC Name: 2-(2-bromo-5-nitrophenyl)-8-[2-(hydroxymethyl)-1-methylpyrrolidin-3-yl]-5,7-dimethoxychromen-4-one Traditional Name: 2-(2-bromo-5-nitro-phenyl)-5,7-dimethoxy-8-(1-methyl-2-methylol-pyrrolidin-3-yl)chromone Formula: C23H23BrN2O7 MolecularWeight: 519.34192

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C1CO)C2=C(C=C(C3=C2OC(=CC3=O)C4=C(C=CC(=C4)[N+](=O)[O-])Br)OC)OC

Isomeric SMILES

CN1CCC(C1CO)C2=C(C=C(C3=C2OC(=CC3=O)C4=C(C=CC(=C4)[N+](=O)[O-])Br)OC)OC

InChI

InChI=1S/C23H23BrN2O7/c1-25-7-6-13(16(25)11-27)21-19(31-2)10-20(32-3)22-17(28)9-18(33-23(21)22)14-8-12(26(29)30)4-5-15(14)24/h4-5,8-10,13,16,27H,6-7,11H2,1-3H3