4-(5-ethanoyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)benzoic acid

Systemtic Name: 4-(5-ethanoyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)benzoic acid Openeye Name: 4-(5-acetyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)benzoic acid CAS Name: 4-(5-acetyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)benzoic acid IUPAC Name: 4-(5-acetyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)benzoic acid Traditional Name: 4-(5-acetyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)benzoic acid Formula: C14H13N3O3 MolecularWeight: 271.27132

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC2=C(C1)NN=C2C3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC(=O)N1CC2=C(C1)NN=C2C3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C14H13N3O3/c1-8(18)17-6-11-12(7-17)15-16-13(11)9-2-4-10(5-3-9)14(19)20/h2-5H,6-7H2,1H3,(H,15,16)(H,19,20)