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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OC(=O)CCCOC2=CC(=C(C=C2)C(C)C)C

Isomeric SMILES

CC1=CC=CC=C1OC(=O)CCCOC2=CC(=C(C=C2)C(C)C)C

InChI

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