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4-[(2S)-2-methylbutoxy]carbonylbenzoic acid

4-[(2S)-2-methylbutoxy]carbonylbenzoic acid

Systemtic Name:4-[(2S)-2-methylbutoxy]carbonylbenzoic acid
Openeye Name:4-[(2S)-2-methylbutoxy]carbonylbenzoic acid
CAS Name:4-[[(2S)-2-methylbutoxy]-oxomethyl]benzoic acid
IUPAC Name:4-[(2S)-2-methylbutoxy]carbonylbenzoic acid
Traditional Name:4-[(2S)-2-methylbutoxy]carbonylbenzoic acid
Formula: C13H16O4
MolecularWeight: 236.26374
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C13H16O4/c1-3-9(2)8-17-13(16)11-6-4-10(5-7-11)12(14)15/h4-7,9H,3,8H2,1-2H3,(H,14,15)/t9-/m0/s1


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