(3-methylphenyl) 4-(3-methyl-4-propan-2-yl-phenoxy)butanoate

Systemtic Name: (3-methylphenyl) 4-(3-methyl-4-propan-2-yl-phenoxy)butanoate Openeye Name: m-tolyl 4-(4-isopropyl-3-methyl-phenoxy)butanoate CAS Name: 4-(3-methyl-4-propan-2-ylphenoxy)butanoic acid (3-methylphenyl) ester IUPAC Name: (3-methylphenyl) 4-(3-methyl-4-propan-2-ylphenoxy)butanoate Traditional Name: 4-(4-isopropyl-3-methyl-phenoxy)butyric acid m-tolyl ester Formula: C21H26O3 MolecularWeight: 326.42934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC(=O)CCCOC2=CC(=C(C=C2)C(C)C)C

Isomeric SMILES

CC1=CC(=CC=C1)OC(=O)CCCOC2=CC(=C(C=C2)C(C)C)C

InChI

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