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

Systemtic Name: 4-[5-(phenylmethyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]benzoic acid Openeye Name: 4-(5-benzyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)benzoic acid CAS Name: 4-[5-(phenylmethyl)-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl]benzoic acid IUPAC Name: 4-(5-benzyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)benzoic acid Traditional Name: 4-(5-benzyl-4,6-dihydro-1H-pyrrolo[3,4-c]pyrazol-3-yl)benzoic acid Formula: C19H17N3O2 MolecularWeight: 319.35718

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Descriptors Computed from Structure

Canonical SMILES:

C1C2=C(CN1CC3=CC=CC=C3)NN=C2C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1C2=C(CN1CC3=CC=CC=C3)NN=C2C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C19H17N3O2/c23-19(24)15-8-6-14(7-9-15)18-16-11-22(12-17(16)20-21-18)10-13-4-2-1-3-5-13/h1-9H,10-12H2,(H,20,21)(H,23,24)