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2,2-dimethyl-9-[4-(4-phenylbutyl)phenoxy]nonanoic acid

2,2-dimethyl-9-[4-(4-phenylbutyl)phenoxy]nonanoic acid

Systemtic Name:2,2-dimethyl-9-[4-(4-phenylbutyl)phenoxy]nonanoic acid
Openeye Name:2,2-dimethyl-9-[4-(4-phenylbutyl)phenoxy]nonanoic acid
CAS Name:2,2-dimethyl-9-[4-(4-phenylbutyl)phenoxy]nonanoic acid
IUPAC Name:2,2-dimethyl-9-[4-(4-phenylbutyl)phenoxy]nonanoic acid
Traditional Name:2,2-dimethyl-9-[4-(4-phenylbutyl)phenoxy]pelargonic acid
Formula: C27H38O3
MolecularWeight: 410.58882
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCCCCOC1=CC=C(C=C1)CCCCC2=CC=CC=C2)C(=O)O


Isomeric SMILES

CC(C)(CCCCCCCOC1=CC=C(C=C1)CCCCC2=CC=CC=C2)C(=O)O


InChI

InChI=1S/C27H38O3/c1-27(2,26(28)29)21-11-4-3-5-12-22-30-25-19-17-24(18-20-25)16-10-9-15-23-13-7-6-8-14-23/h6-8,13-14,17-20H,3-5,9-12,15-16,21-22H2,1-2H3,(H,28,29)


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