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

Systemtic Name: 2-(4-azanyl-2-bromanyl-phenyl)-8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-5,7-dimethoxy-chromen-4-one Openeye Name: 2-(4-amino-2-bromo-phenyl)-8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-5,7-dimethoxy-chromen-4-one CAS Name: 2-(4-amino-2-bromophenyl)-8-[2-(hydroxymethyl)-1-methyl-3-pyrrolidinyl]-5,7-dimethoxy-1-benzopyran-4-one IUPAC Name: 2-(4-amino-2-bromophenyl)-8-[2-(hydroxymethyl)-1-methylpyrrolidin-3-yl]-5,7-dimethoxychromen-4-one Traditional Name: 2-(4-amino-2-bromo-phenyl)-5,7-dimethoxy-8-(1-methyl-2-methylol-pyrrolidin-3-yl)chromone Formula: C23H25BrN2O5 MolecularWeight: 489.359

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25BrN2O5/c1-26-7-6-14(16(26)11-27)21-19(29-2)10-20(30-3)22-17(28)9-18(31-23(21)22)13-5-4-12(25)8-15(13)24/h4-5,8-10,14,16,27H,6-7,11,25H2,1-3H3