phenyl 3-oxidanyl-2-propan-2-yl-heptanoate

Systemtic Name: phenyl 3-oxidanyl-2-propan-2-yl-heptanoate Openeye Name: phenyl 3-hydroxy-2-isopropyl-heptanoate CAS Name: 3-hydroxy-2-propan-2-ylheptanoic acid phenyl ester IUPAC Name: phenyl 3-hydroxy-2-propan-2-ylheptanoate Traditional Name: 3-hydroxy-2-isopropyl-enanthic acid phenyl ester Formula: C16H24O3 MolecularWeight: 264.35996

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24O3/c1-4-5-11-14(17)15(12(2)3)16(18)19-13-9-7-6-8-10-13/h6-10,12,14-15,17H,4-5,11H2,1-3H3