4-[[(4S)-4-methylhexoxy]methyl]benzoic acid

Systemtic Name: 4-[[(4S)-4-methylhexoxy]methyl]benzoic acid Openeye Name: 4-[[(4S)-4-methylhexoxy]methyl]benzoic acid CAS Name: 4-[[(4S)-4-methylhexoxy]methyl]benzoic acid IUPAC Name: 4-[[(4S)-4-methylhexoxy]methyl]benzoic acid Traditional Name: 4-[[(4S)-4-methylhexoxy]methyl]benzoic acid Formula: C15H22O3 MolecularWeight: 250.33338

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCOCC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC[C@H](C)CCCOCC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C15H22O3/c1-3-12(2)5-4-10-18-11-13-6-8-14(9-7-13)15(16)17/h6-9,12H,3-5,10-11H2,1-2H3,(H,16,17)/t12-/m0/s1