methyl 4-(2-butoxy-5-phenyl-phenyl)butanoate

Systemtic Name: methyl 4-(2-butoxy-5-phenyl-phenyl)butanoate Openeye Name: methyl 4-(2-butoxy-5-phenyl-phenyl)butanoate CAS Name: 4-(2-butoxy-5-phenylphenyl)butanoic acid methyl ester IUPAC Name: methyl 4-(2-butoxy-5-phenylphenyl)butanoate Traditional Name: 4-(2-butoxy-5-phenyl-phenyl)butyric acid methyl ester Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C2=CC=CC=C2)CCCC(=O)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C2=CC=CC=C2)CCCC(=O)OC

InChI

InChI=1S/C21H26O3/c1-3-4-15-24-20-14-13-18(17-9-6-5-7-10-17)16-19(20)11-8-12-21(22)23-2/h5-7,9-10,13-14,16H,3-4,8,11-12,15H2,1-2H3