[6-chloranyl-3-iodanyl-5,8-dimethoxy-4-(methoxymethoxy)naphthalen-2-yl]methyl 4-methylpent-2-ynoate

Systemtic Name: [6-chloranyl-3-iodanyl-5,8-dimethoxy-4-(methoxymethoxy)naphthalen-2-yl]methyl 4-methylpent-2-ynoate Openeye Name: [6-chloro-3-iodo-5,8-dimethoxy-4-(methoxymethoxy)-2-naphthyl]methyl 4-methylpent-2-ynoate CAS Name: 4-methyl-2-pentynoic acid [6-chloro-3-iodo-5,8-dimethoxy-4-(methoxymethoxy)-2-naphthalenyl]methyl ester IUPAC Name: [6-chloro-3-iodo-5,8-dimethoxy-4-(methoxymethoxy)naphthalen-2-yl]methyl 4-methylpent-2-ynoate Traditional Name: 4-methylpent-2-ynoic acid [6-chloro-3-iodo-5,8-dimethoxy-4-(methoxymethoxy)-2-naphthyl]methyl ester Formula: C21H22ClIO6 MolecularWeight: 532.75325

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C#CC(=O)OCC1=C(C(=C2C(=C1)C(=CC(=C2OC)Cl)OC)OCOC)I

Isomeric SMILES

CC(C)C#CC(=O)OCC1=C(C(=C2C(=C1)C(=CC(=C2OC)Cl)OC)OCOC)I

InChI

InChI=1S/C21H22ClIO6/c1-12(2)6-7-17(24)28-10-13-8-14-16(26-4)9-15(22)20(27-5)18(14)21(19(13)23)29-11-25-3/h8-9,12H,10-11H2,1-5H3