5-(5-propanoyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)thiophene-2-carboxylic acid

Systemtic Name: 5-(5-propanoyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)thiophene-2-carboxylic acid Openeye Name: 5-(5-propanoyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)thiophene-2-carboxylic acid CAS Name: 5-[5-(1-oxopropyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]-2-thiophenecarboxylic acid IUPAC Name: 5-(5-propanoyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)thiophene-2-carboxylic acid Traditional Name: 5-(5-propionyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)-2-thenoic acid Formula: C13H13N3O3S MolecularWeight: 291.32562

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CC2=C(C1)NN=C2C3=CC=C(S3)C(=O)O

Isomeric SMILES

CCC(=O)N1CC2=C(C1)NN=C2C3=CC=C(S3)C(=O)O

InChI

InChI=1S/C13H13N3O3S/c1-2-11(17)16-5-7-8(6-16)14-15-12(7)9-3-4-10(20-9)13(18)19/h3-4H,2,5-6H2,1H3,(H,14,15)(H,18,19)