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

Systemtic Name: 4-[[4-[(2-chloranyl-4-methoxy-phenoxy)methyl]phenyl]methyl]heptane-3,5-dione Openeye Name: 4-[[4-[(2-chloro-4-methoxy-phenoxy)methyl]phenyl]methyl]heptane-3,5-dione CAS Name: 4-[[4-[(2-chloro-4-methoxyphenoxy)methyl]phenyl]methyl]heptane-3,5-dione IUPAC Name: 4-[[4-[(2-chloro-4-methoxyphenoxy)methyl]phenyl]methyl]heptane-3,5-dione Traditional Name: 4-[4-[(2-chloro-4-methoxy-phenoxy)methyl]benzyl]heptane-3,5-dione Formula: C22H25ClO4 MolecularWeight: 388.8845

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C(CC1=CC=C(C=C1)COC2=C(C=C(C=C2)OC)Cl)C(=O)CC

Isomeric SMILES

CCC(=O)C(CC1=CC=C(C=C1)COC2=C(C=C(C=C2)OC)Cl)C(=O)CC

InChI

InChI=1S/C22H25ClO4/c1-4-20(24)18(21(25)5-2)12-15-6-8-16(9-7-15)14-27-22-11-10-17(26-3)13-19(22)23/h6-11,13,18H,4-5,12,14H2,1-3H3