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

Systemtic Name: 4-[5-(3-oxidanyl-2-thiophen-2-yl-propanoyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]benzoic acid Openeye Name: 4-[5-[3-hydroxy-2-(2-thienyl)propanoyl]-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]benzoic acid CAS Name: 4-[5-(3-hydroxy-1-oxo-2-thiophen-2-ylpropyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]benzoic acid IUPAC Name: 4-[5-(3-hydroxy-2-thiophen-2-ylpropanoyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]benzoic acid Traditional Name: 4-[5-[3-hydroxy-2-(2-thienyl)propanoyl]-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]benzoic acid Formula: C19H17N3O4S MolecularWeight: 383.42098

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(CN1C(=O)C(CO)C3=CC=CS3)NN=C2C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1C2=C(CN1C(=O)C(CO)C3=CC=CS3)NN=C2C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C19H17N3O4S/c23-10-14(16-2-1-7-27-16)18(24)22-8-13-15(9-22)20-21-17(13)11-3-5-12(6-4-11)19(25)26/h1-7,14,23H,8-10H2,(H,20,21)(H,25,26)