methyl 4-[4-(2-oxidanylbutoxy)-3-phenyl-phenyl]butanoate

Systemtic Name: methyl 4-[4-(2-oxidanylbutoxy)-3-phenyl-phenyl]butanoate Openeye Name: methyl 4-[4-(2-hydroxybutoxy)-3-phenyl-phenyl]butanoate CAS Name: 4-[4-(2-hydroxybutoxy)-3-phenylphenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(2-hydroxybutoxy)-3-phenylphenyl]butanoate Traditional Name: 4-[4-(2-hydroxybutoxy)-3-phenyl-phenyl]butyric acid methyl ester Formula: C21H26O4 MolecularWeight: 342.42874

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC1=C(C=C(C=C1)CCCC(=O)OC)C2=CC=CC=C2)O

Isomeric SMILES

CCC(COC1=C(C=C(C=C1)CCCC(=O)OC)C2=CC=CC=C2)O

InChI

InChI=1S/C21H26O4/c1-3-18(22)15-25-20-13-12-16(8-7-11-21(23)24-2)14-19(20)17-9-5-4-6-10-17/h4-6,9-10,12-14,18,22H,3,7-8,11,15H2,1-2H3