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

Systemtic Name: 2-(2-chloranyl-4-methoxy-phenyl)-8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-5,7-dimethoxy-chromen-4-one Openeye Name: 2-(2-chloro-4-methoxy-phenyl)-8-[2-(hydroxymethyl)-1-methyl-pyrrolidin-3-yl]-5,7-dimethoxy-chromen-4-one CAS Name: 2-(2-chloro-4-methoxyphenyl)-8-[2-(hydroxymethyl)-1-methyl-3-pyrrolidinyl]-5,7-dimethoxy-1-benzopyran-4-one IUPAC Name: 2-(2-chloro-4-methoxyphenyl)-8-[2-(hydroxymethyl)-1-methylpyrrolidin-3-yl]-5,7-dimethoxychromen-4-one Traditional Name: 2-(2-chloro-4-methoxy-phenyl)-5,7-dimethoxy-8-(1-methyl-2-methylol-pyrrolidin-3-yl)chromone Formula: C24H26ClNO6 MolecularWeight: 459.91934

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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)OC)Cl)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C24H26ClNO6/c1-26-8-7-15(17(26)12-27)22-20(30-3)11-21(31-4)23-18(28)10-19(32-24(22)23)14-6-5-13(29-2)9-16(14)25/h5-6,9-11,15,17,27H,7-8,12H2,1-4H3