4-[4-(2-chloranyl-4-methoxy-phenoxy)butyl]heptane-3,5-dione

Systemtic Name: 4-[4-(2-chloranyl-4-methoxy-phenoxy)butyl]heptane-3,5-dione Openeye Name: 4-[4-(2-chloro-4-methoxy-phenoxy)butyl]heptane-3,5-dione CAS Name: 4-[4-(2-chloro-4-methoxyphenoxy)butyl]heptane-3,5-dione IUPAC Name: 4-[4-(2-chloro-4-methoxyphenoxy)butyl]heptane-3,5-dione Traditional Name: 4-[4-(2-chloro-4-methoxy-phenoxy)butyl]heptane-3,5-dione Formula: C18H25ClO4 MolecularWeight: 340.8417

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CCCCOC1=C(C=C(C=C1)OC)Cl)C(=O)CC

Isomeric SMILES

CCC(=O)C(CCCCOC1=C(C=C(C=C1)OC)Cl)C(=O)CC

InChI

InChI=1S/C18H25ClO4/c1-4-16(20)14(17(21)5-2)8-6-7-11-23-18-10-9-13(22-3)12-15(18)19/h9-10,12,14H,4-8,11H2,1-3H3