methyl 4-[4-(3-chloranylbutoxy)-3-phenyl-phenyl]butanoate

Systemtic Name: methyl 4-[4-(3-chloranylbutoxy)-3-phenyl-phenyl]butanoate Openeye Name: methyl 4-[4-(3-chlorobutoxy)-3-phenyl-phenyl]butanoate CAS Name: 4-[4-(3-chlorobutoxy)-3-phenylphenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-(3-chlorobutoxy)-3-phenylphenyl]butanoate Traditional Name: 4-[4-(3-chlorobutoxy)-3-phenyl-phenyl]butyric acid methyl ester Formula: C21H25ClO3 MolecularWeight: 360.8744

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCOC1=C(C=C(C=C1)CCCC(=O)OC)C2=CC=CC=C2)Cl

Isomeric SMILES

CC(CCOC1=C(C=C(C=C1)CCCC(=O)OC)C2=CC=CC=C2)Cl

InChI

InChI=1S/C21H25ClO3/c1-16(22)13-14-25-20-12-11-17(7-6-10-21(23)24-2)15-19(20)18-8-4-3-5-9-18/h3-5,8-9,11-12,15-16H,6-7,10,13-14H2,1-2H3