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4-[(prop-2-ynoylamino)methyl]benzoic acid

4-[(prop-2-ynoylamino)methyl]benzoic acid

Systemtic Name:4-[(prop-2-ynoylamino)methyl]benzoic acid
Openeye Name:4-[(prop-2-ynoylamino)methyl]benzoic acid
CAS Name:4-[(1-oxoprop-2-ynylamino)methyl]benzoic acid
IUPAC Name:4-[(prop-2-ynoylamino)methyl]benzoic acid
Traditional Name:4-[(propioloylamino)methyl]benzoic acid
Formula: C11H9NO3
MolecularWeight: 203.19406
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Descriptors Computed from Structure

Canonical SMILES:

C#CC(=O)NCC1=CC=C(C=C1)C(=O)O


Isomeric SMILES

C#CC(=O)NCC1=CC=C(C=C1)C(=O)O


InChI

InChI=1S/C11H9NO3/c1-2-10(13)12-7-8-3-5-9(6-4-8)11(14)15/h1,3-6H,7H2,(H,12,13)(H,14,15)


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