3-[2-(1,2-dimethylindol-3-yl)-2-oxidanylidene-ethoxy]-5-methyl-1-oxidanyl-xanthen-9-one

Systemtic Name: 3-[2-(1,2-dimethylindol-3-yl)-2-oxidanylidene-ethoxy]-5-methyl-1-oxidanyl-xanthen-9-one Openeye Name: 3-[2-(1,2-dimethylindol-3-yl)-2-oxo-ethoxy]-1-hydroxy-5-methyl-xanthen-9-one CAS Name: 3-[2-(1,2-dimethyl-3-indolyl)-2-oxoethoxy]-1-hydroxy-5-methyl-9-xanthenone IUPAC Name: 3-[2-(1,2-dimethylindol-3-yl)-2-oxoethoxy]-1-hydroxy-5-methylxanthen-9-one Traditional Name: 3-[2-(1,2-dimethylindol-3-yl)-2-keto-ethoxy]-1-hydroxy-5-methyl-xanthone Formula: C26H21NO5 MolecularWeight: 427.44864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OC3=CC(=CC(=C3C2=O)O)OCC(=O)C4=C(N(C5=CC=CC=C54)C)C

Isomeric SMILES

CC1=CC=CC2=C1OC3=CC(=CC(=C3C2=O)O)OCC(=O)C4=C(N(C5=CC=CC=C54)C)C

InChI

InChI=1S/C26H21NO5/c1-14-7-6-9-18-25(30)24-20(28)11-16(12-22(24)32-26(14)18)31-13-21(29)23-15(2)27(3)19-10-5-4-8-17(19)23/h4-12,28H,13H2,1-3H3