2-[1-[(4-chlorophenyl)methyl]-5-methyl-2-propyl-indol-3-yl]acetic acid - CAS 147-18-2
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Catalog Number: M071529
CAS Number: 147-18-2
PubChem Substance ID:355100124
Molecular Formula: C21H22ClNO2
Molecular Weight:355.862
Purity: ≥95%
* For research use only. Not for human or veterinary use.
Synonym
Synonyms | 2-[1-[(4-chlorophenyl)methyl]-5-methyl-2-propyl-indol-3-yl]acetic acid |
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Property
Molecular Formula: | C21H22ClNO2 |
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Molecular Weight | 355.862 |
Purity | ≥95% |
Storage | 3 years -20C powder |
Computed Descriptor
IUPAC Name | 2-[1-[(4-chlorophenyl)methyl]-5-methyl-2-propylindol-3-yl]acetic acid |
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InChI | InChI=1S/C21H22ClNO2/c1-3-4-19-18(12-21(24)25)17-11-14(2)5-10-20(17)23(19)13-15-6-8-16(22)9-7-15/h5-11H,3-4,12-13H2,1-2H3,(H,24,25) |
InChIKey | QPTZOWAAFDRYEL-UHFFFAOYSA-N |
SMILES | CCCC1=C(C2=C(N1CC3=CC=C(C=C3)Cl)C=CC(=C2)C)CC(=O)O |