4-(4-chloranylphenoxy)-2-phenoxy-dodecanoic acid

Systemtic Name: 4-(4-chloranylphenoxy)-2-phenoxy-dodecanoic acid Openeye Name: 4-(4-chlorophenoxy)-2-phenoxy-dodecanoic acid CAS Name: 4-(4-chlorophenoxy)-2-phenoxydodecanoic acid IUPAC Name: 4-(4-chlorophenoxy)-2-phenoxydodecanoic acid Traditional Name: 4-(4-chlorophenoxy)-2-phenoxy-lauric acid Formula: C24H31ClO4 MolecularWeight: 418.95354

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(CC(C(=O)O)OC1=CC=CC=C1)OC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCCCCCC(CC(C(=O)O)OC1=CC=CC=C1)OC2=CC=C(C=C2)Cl

InChI

InChI=1S/C24H31ClO4/c1-2-3-4-5-6-8-13-22(28-21-16-14-19(25)15-17-21)18-23(24(26)27)29-20-11-9-7-10-12-20/h7,9-12,14-17,22-23H,2-6,8,13,18H2,1H3,(H,26,27)