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

Systemtic Name: 2-(4-bromophenyl)-8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-7-methoxy-5-oxidanyl-chromen-4-one Openeye Name: 2-(4-bromophenyl)-5-hydroxy-8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-7-methoxy-chromen-4-one CAS Name: 2-(4-bromophenyl)-5-hydroxy-8-[2-(hydroxymethyl)-1-methyl-3-pyrrolidinyl]-7-methoxy-1-benzopyran-4-one IUPAC Name: 2-(4-bromophenyl)-5-hydroxy-8-[2-(hydroxymethyl)-1-methylpyrrolidin-3-yl]-7-methoxychromen-4-one Traditional Name: 2-(4-bromophenyl)-5-hydroxy-7-methoxy-8-(1-methyl-2-methylol-pyrrolidin-3-yl)chromone Formula: C22H22BrNO5 MolecularWeight: 460.31778

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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)O)OC

Isomeric SMILES

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

InChI

InChI=1S/C22H22BrNO5/c1-24-8-7-14(15(24)11-25)20-19(28-2)10-17(27)21-16(26)9-18(29-22(20)21)12-3-5-13(23)6-4-12/h3-6,9-10,14-15,25,27H,7-8,11H2,1-2H3