5-methylhexyl 2-propan-2-ylbenzoate

Systemtic Name: 5-methylhexyl 2-propan-2-ylbenzoate Openeye Name: 5-methylhexyl 2-isopropylbenzoate CAS Name: 2-propan-2-ylbenzoic acid 5-methylhexyl ester IUPAC Name: 5-methylhexyl 2-propan-2-ylbenzoate Traditional Name: 2-isopropylbenzoic acid 5-methylhexyl ester Formula: C17H26O2 MolecularWeight: 262.38714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCOC(=O)C1=CC=CC=C1C(C)C

Isomeric SMILES

CC(C)CCCCOC(=O)C1=CC=CC=C1C(C)C

InChI

InChI=1S/C17H26O2/c1-13(2)9-7-8-12-19-17(18)16-11-6-5-10-15(16)14(3)4/h5-6,10-11,13-14H,7-9,12H2,1-4H3