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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > c-nitro compound > 2-thiophen-2-ylacetic acid [[amino-(4-nitrophenyl)methylidene]amino] ester

Preferred term

2-thiophen-2-ylacetic acid [[amino-(4-nitrophenyl)methylidene]amino] ester  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C13H11N3O4S

inchi

  • InChI=1S/C13H11N3O4S/c14-13(9-3-5-10(6-4-9)16(18)19)15-20-12(17)8-11-2-1-7-21-11/h1-7H,8H2,(H2,14,15)

inchikey

  • KVFICKQAEHURRP-UHFFFAOYSA-N

mass

  • 305.311

monoisotopicmass

  • 305.04703

smiles

  • C1=CSC(=C1)CC(=O)ON=C(C2=CC=C(C=C2)[N+](=O)[O-])N

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:120809

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