3-(2-bromanylphenoxy)-7-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxidanylidene-ethoxy]-2-methyl-chromen-4-one

Systemtic Name: 3-(2-bromanylphenoxy)-7-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxidanylidene-ethoxy]-2-methyl-chromen-4-one Openeye Name: 3-(2-bromophenoxy)-7-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxo-ethoxy]-2-methyl-chromen-4-one CAS Name: 3-(2-bromophenoxy)-7-[2-[(2S)-2-(hydroxymethyl)-1-pyrrolidinyl]-2-oxoethoxy]-2-methyl-1-benzopyran-4-one IUPAC Name: 3-(2-bromophenoxy)-7-[2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]-2-oxoethoxy]-2-methylchromen-4-one Traditional Name: 3-(2-bromophenoxy)-7-[2-keto-2-[(2S)-2-methylolpyrrolidino]ethoxy]-2-methyl-chromone Formula: C23H22BrNO6 MolecularWeight: 488.32788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)N3CCCC3CO)OC4=CC=CC=C4Br

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OCC(=O)N3CCC[C@H]3CO)OC4=CC=CC=C4Br

InChI

InChI=1S/C23H22BrNO6/c1-14-23(31-19-7-3-2-6-18(19)24)22(28)17-9-8-16(11-20(17)30-14)29-13-21(27)25-10-4-5-15(25)12-26/h2-3,6-9,11,15,26H,4-5,10,12-13H2,1H3/t15-/m0/s1