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2-[(2S,3R,7R)-3,7-dimethyltridecan-2-yl]oxycarbonylbenzoic acid

2-[(2S,3R,7R)-3,7-dimethyltridecan-2-yl]oxycarbonylbenzoic acid

Systemtic Name:2-[(2S,3R,7R)-3,7-dimethyltridecan-2-yl]oxycarbonylbenzoic acid
Openeye Name:2-[(1S,2R,6R)-1,2,6-trimethyldodecoxy]carbonylbenzoic acid
CAS Name:2-[[(2S,3R,7R)-3,7-dimethyltridecan-2-yl]oxy-oxomethyl]benzoic acid
IUPAC Name:2-[(2S,3R,7R)-3,7-dimethyltridecan-2-yl]oxycarbonylbenzoic acid
Traditional Name:2-[(1S,2R,6R)-1,2,6-trimethyldodecoxy]carbonylbenzoic acid
Formula: C23H36O4
MolecularWeight: 376.52954
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)CCCC(C)C(C)OC(=O)C1=CC=CC=C1C(=O)O


Isomeric SMILES

CCCCCC[C@@H](C)CCC[C@@H](C)[C@H](C)OC(=O)C1=CC=CC=C1C(=O)O


InChI

InChI=1S/C23H36O4/c1-5-6-7-8-12-17(2)13-11-14-18(3)19(4)27-23(26)21-16-10-9-15-20(21)22(24)25/h9-10,15-19H,5-8,11-14H2,1-4H3,(H,24,25)/t17-,18-,19+/m1/s1


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