methyl 4-[4-[3-(4-methylphenyl)-1-oxidanyl-propyl]phenyl]butanoate

Systemtic Name: methyl 4-[4-[3-(4-methylphenyl)-1-oxidanyl-propyl]phenyl]butanoate Openeye Name: methyl 4-[4-[1-hydroxy-3-(p-tolyl)propyl]phenyl]butanoate CAS Name: 4-[4-[1-hydroxy-3-(4-methylphenyl)propyl]phenyl]butanoic acid methyl ester IUPAC Name: methyl 4-[4-[1-hydroxy-3-(4-methylphenyl)propyl]phenyl]butanoate Traditional Name: 4-[4-[1-hydroxy-3-(p-tolyl)propyl]phenyl]butyric acid methyl ester Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CCC(C2=CC=C(C=C2)CCCC(=O)OC)O

Isomeric SMILES

CC1=CC=C(C=C1)CCC(C2=CC=C(C=C2)CCCC(=O)OC)O

InChI

InChI=1S/C21H26O3/c1-16-6-8-18(9-7-16)12-15-20(22)19-13-10-17(11-14-19)4-3-5-21(23)24-2/h6-11,13-14,20,22H,3-5,12,15H2,1-2H3