3-(3-tert-butyl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid

Systemtic Name: 3-(3-tert-butyl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid Openeye Name: 3-(3-tert-butyl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid CAS Name: 3-(3-tert-butyl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid IUPAC Name: 3-(3-tert-butyl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid Traditional Name: 3-(3-tert-butyl-4,5-dihydro-2H-pyrrolo[2,3-c]pyrazol-1-yl)benzoic acid Formula: C16H19N3O2 MolecularWeight: 285.34096

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2CCN=C2N(N1)C3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC(C)(C)C1=C2CCN=C2N(N1)C3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C16H19N3O2/c1-16(2,3)13-12-7-8-17-14(12)19(18-13)11-6-4-5-10(9-11)15(20)21/h4-6,9,18H,7-8H2,1-3H3,(H,20,21)