(5-methyl-2-propan-2-yl-phenyl) 4-tert-butylbenzoate

Systemtic Name: (5-methyl-2-propan-2-yl-phenyl) 4-tert-butylbenzoate Openeye Name: (2-isopropyl-5-methyl-phenyl) 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid (5-methyl-2-propan-2-ylphenyl) ester IUPAC Name: (5-methyl-2-propan-2-ylphenyl) 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid (2-isopropyl-5-methyl-phenyl) ester Formula: C21H26O2 MolecularWeight: 310.42994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26O2/c1-14(2)18-12-7-15(3)13-19(18)23-20(22)16-8-10-17(11-9-16)21(4,5)6/h7-14H,1-6H3