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2-[(3S)-3-methylpentoxy]carbonylbenzoic acid

2-[(3S)-3-methylpentoxy]carbonylbenzoic acid

Systemtic Name:2-[(3S)-3-methylpentoxy]carbonylbenzoic acid
Openeye Name:2-[(3S)-3-methylpentoxy]carbonylbenzoic acid
CAS Name:2-[[(3S)-3-methylpentoxy]-oxomethyl]benzoic acid
IUPAC Name:2-[(3S)-3-methylpentoxy]carbonylbenzoic acid
Traditional Name:2-[(3S)-3-methylpentoxy]carbonylbenzoic acid
Formula: C14H18O4
MolecularWeight: 250.29032
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCOC(=O)C1=CC=CC=C1C(=O)O


Isomeric SMILES

CC[C@H](C)CCOC(=O)C1=CC=CC=C1C(=O)O


InChI

InChI=1S/C14H18O4/c1-3-10(2)8-9-18-14(17)12-7-5-4-6-11(12)13(15)16/h4-7,10H,3,8-9H2,1-2H3,(H,15,16)/t10-/m0/s1


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