propan-2-yl 6-bromanyl-3-ethyl-3-phenyl-hexanoate

Systemtic Name: propan-2-yl 6-bromanyl-3-ethyl-3-phenyl-hexanoate Openeye Name: isopropyl 6-bromo-3-ethyl-3-phenyl-hexanoate CAS Name: 6-bromo-3-ethyl-3-phenylhexanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 6-bromo-3-ethyl-3-phenylhexanoate Traditional Name: 6-bromo-3-ethyl-3-phenyl-hexanoic acid isopropyl ester Formula: C17H25BrO2 MolecularWeight: 341.2832

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCBr)(CC(=O)OC(C)C)C1=CC=CC=C1

Isomeric SMILES

CCC(CCCBr)(CC(=O)OC(C)C)C1=CC=CC=C1

InChI

InChI=1S/C17H25BrO2/c1-4-17(11-8-12-18,13-16(19)20-14(2)3)15-9-6-5-7-10-15/h5-7,9-10,14H,4,8,11-13H2,1-3H3