3-[[2,4-bis(chloranyl)-6-methyl-phenyl]methyl]-4-butoxy-cyclobut-3-ene-1,2-dione

Systemtic Name: 3-[[2,4-bis(chloranyl)-6-methyl-phenyl]methyl]-4-butoxy-cyclobut-3-ene-1,2-dione Openeye Name: 3-butoxy-4-[(2,4-dichloro-6-methyl-phenyl)methyl]cyclobut-3-ene-1,2-dione CAS Name: 3-butoxy-4-[(2,4-dichloro-6-methylphenyl)methyl]cyclobut-3-ene-1,2-dione IUPAC Name: 3-butoxy-4-[(2,4-dichloro-6-methylphenyl)methyl]cyclobut-3-ene-1,2-dione Traditional Name: 3-butoxy-4-(2,4-dichloro-6-methyl-benzyl)cyclobut-3-ene-1,2-quinone Formula: C16H16Cl2O3 MolecularWeight: 327.20244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(=O)C1=O)CC2=C(C=C(C=C2C)Cl)Cl

Isomeric SMILES

CCCCOC1=C(C(=O)C1=O)CC2=C(C=C(C=C2C)Cl)Cl

InChI

InChI=1S/C16H16Cl2O3/c1-3-4-5-21-16-12(14(19)15(16)20)8-11-9(2)6-10(17)7-13(11)18/h6-7H,3-5,8H2,1-2H3