2-azanyl-4-ethynyl-thiophene-3-carboxylic acid; bicyclo[2.2.0]hexa-1(4),2,5-triene

Systemtic Name: 2-azanyl-4-ethynyl-thiophene-3-carboxylic acid; bicyclo[2.2.0]hexa-1(4),2,5-triene Openeye Name: 2-amino-4-ethynyl-thiophene-3-carboxylic acid; bicyclo[2.2.0]hexa-1(4),2,5-triene CAS Name: 2-amino-4-ethynyl-3-thiophenecarboxylic acid; bicyclo[2.2.0]hexa-1(4),2,5-triene IUPAC Name: 2-amino-4-ethynylthiophene-3-carboxylic acid; bicyclo[2.2.0]hexa-1(4),2,5-triene Traditional Name: 2-amino-4-ethynyl-3-thenoic acid; bicyclo[2.2.0]hexa-1(4),2,5-triene Formula: C13H9NO2S MolecularWeight: 243.28106

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=CSC(=C1C(=O)O)N.C1=CC2=C1C=C2

Isomeric SMILES

C#CC1=CSC(=C1C(=O)O)N.C1=CC2=C1C=C2

InChI

InChI=1S/C7H5NO2S.C6H4/c1-2-4-3-11-6(8)5(4)7(9)10;1-2-6-4-3-5(1)6/h1,3H,8H2,(H,9,10);1-4H