1-[7-chloranyl-3-(hydroxymethyl)-5,8-dimethoxy-1-(methoxymethoxy)naphthalen-2-yl]-4-methyl-pent-2-yn-1-one

Systemtic Name: 1-[7-chloranyl-3-(hydroxymethyl)-5,8-dimethoxy-1-(methoxymethoxy)naphthalen-2-yl]-4-methyl-pent-2-yn-1-one Openeye Name: 1-[7-chloro-3-(hydroxymethyl)-5,8-dimethoxy-1-(methoxymethoxy)-2-naphthyl]-4-methyl-pent-2-yn-1-one CAS Name: 1-[7-chloro-3-(hydroxymethyl)-5,8-dimethoxy-1-(methoxymethoxy)-2-naphthalenyl]-4-methyl-2-pentyn-1-one IUPAC Name: 1-[7-chloro-3-(hydroxymethyl)-5,8-dimethoxy-1-(methoxymethoxy)naphthalen-2-yl]-4-methylpent-2-yn-1-one Traditional Name: 1-[7-chloro-5,8-dimethoxy-1-(methoxymethoxy)-3-methylol-2-naphthyl]-4-methyl-pent-2-yn-1-one Formula: C21H23ClO6 MolecularWeight: 406.85672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C#CC(=O)C1=C(C=C2C(=CC(=C(C2=C1OCOC)OC)Cl)OC)CO

Isomeric SMILES

CC(C)C#CC(=O)C1=C(C=C2C(=CC(=C(C2=C1OCOC)OC)Cl)OC)CO

InChI

InChI=1S/C21H23ClO6/c1-12(2)6-7-16(24)18-13(10-23)8-14-17(26-4)9-15(22)20(27-5)19(14)21(18)28-11-25-3/h8-9,12,23H,10-11H2,1-5H3