phenyl 3-ethyl-3-oxidanyl-2-propan-2-yl-pentanoate

Systemtic Name: phenyl 3-ethyl-3-oxidanyl-2-propan-2-yl-pentanoate Openeye Name: phenyl 3-ethyl-3-hydroxy-2-isopropyl-pentanoate CAS Name: 3-ethyl-3-hydroxy-2-propan-2-ylpentanoic acid phenyl ester IUPAC Name: phenyl 3-ethyl-3-hydroxy-2-propan-2-ylpentanoate Traditional Name: 3-ethyl-3-hydroxy-2-isopropyl-valeric acid phenyl ester Formula: C16H24O3 MolecularWeight: 264.35996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(C(C)C)C(=O)OC1=CC=CC=C1)O

Isomeric SMILES

CCC(CC)(C(C(C)C)C(=O)OC1=CC=CC=C1)O

InChI

InChI=1S/C16H24O3/c1-5-16(18,6-2)14(12(3)4)15(17)19-13-10-8-7-9-11-13/h7-12,14,18H,5-6H2,1-4H3