phenol; (2-propylphenyl) 2-tert-butylbenzoate

Systemtic Name: phenol; (2-propylphenyl) 2-tert-butylbenzoate Openeye Name: phenol; (2-propylphenyl) 2-tert-butylbenzoate CAS Name: 2-tert-butylbenzoic acid (2-propylphenyl) ester; phenol IUPAC Name: phenol; (2-propylphenyl) 2-tert-butylbenzoate Traditional Name: 2-tert-butylbenzoic acid (2-propylphenyl) ester; phenol Formula: C26H30O3 MolecularWeight: 390.5146

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=CC=C1OC(=O)C2=CC=CC=C2C(C)(C)C.C1=CC=C(C=C1)O

Isomeric SMILES

CCCC1=CC=CC=C1OC(=O)C2=CC=CC=C2C(C)(C)C.C1=CC=C(C=C1)O

InChI

InChI=1S/C20H24O2.C6H6O/c1-5-10-15-11-6-9-14-18(15)22-19(21)16-12-7-8-13-17(16)20(2,3)4;7-6-4-2-1-3-5-6/h6-9,11-14H,5,10H2,1-4H3;1-5,7H