hexadecyl 4-tert-butylbenzoate

Systemtic Name: hexadecyl 4-tert-butylbenzoate Openeye Name: hexadecyl 4-tert-butylbenzoate CAS Name: 4-tert-butylbenzoic acid hexadecyl ester IUPAC Name: hexadecyl 4-tert-butylbenzoate Traditional Name: 4-tert-butylbenzoic acid cetyl ester Formula: C27H46O2 MolecularWeight: 402.65294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCOC(=O)C1=CC=C(C=C1)C(C)(C)C

InChI

InChI=1S/C27H46O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23-29-26(28)24-19-21-25(22-20-24)27(2,3)4/h19-22H,5-18,23H2,1-4H3