Concept information
Preferred term
4 (3 متیلانیلینو) اگزوبوتانوئیک اسید ( بروموفنیل) متیل استر
Type
-
http://www.irandoc.ac.ir/onto/irandoc-meta/Concept
Broader concept
charge
- 0
formula
- C18H18BrNO3
has_functional_parent
inchi
- InChI=1S/C18H18BrNO3/c1-13-3-2-4-16(11-13)20-17(21)9-10-18(22)23-12-14-5-7-15(19)8-6-14/h2-8,11H,9-10,12H2,1H3,(H,20,21)
inchikey
- KAGHTNIGBARZLK-UHFFFAOYSA-N
mass
- 376.245
monoisotopicmass
- 375.04701
smiles
- CC1=CC(=CC=C1)NC(=O)CCC(=O)OCC2=CC=C(C=C2)Br
subset
- 2_STAR
In other languages
URI
http://www.irandoc.acir/onto/irandoc/CHEBI:113175
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