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

Systemtic Name: 2-(4-bromophenyl)-8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-5,7-dimethoxy-chromen-4-one Openeye Name: 2-(4-bromophenyl)-8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-5,7-dimethoxy-chromen-4-one CAS Name: 2-(4-bromophenyl)-8-[2-(hydroxymethyl)-1-methyl-3-pyrrolidinyl]-5,7-dimethoxy-1-benzopyran-4-one IUPAC Name: 2-(4-bromophenyl)-8-[2-(hydroxymethyl)-1-methylpyrrolidin-3-yl]-5,7-dimethoxychromen-4-one Traditional Name: 2-(4-bromophenyl)-5,7-dimethoxy-8-(1-methyl-2-methylol-pyrrolidin-3-yl)chromone Formula: C23H24BrNO5 MolecularWeight: 474.34436

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(C1CO)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC=C(C=C4)Br)OC)OC

Isomeric SMILES

CN1CCC(C1CO)C2=C(C=C(C3=C2OC(=CC3=O)C4=CC=C(C=C4)Br)OC)OC

InChI

InChI=1S/C23H24BrNO5/c1-25-9-8-15(16(25)12-26)21-19(28-2)11-20(29-3)22-17(27)10-18(30-23(21)22)13-4-6-14(24)7-5-13/h4-7,10-11,15-16,26H,8-9,12H2,1-3H3