benzenesulfonic acid; 1-cyclopentyl-7-ethoxy-3-ethyl-4,5-dihydropyrazolo[3,4-c]pyridine

Systemtic Name: benzenesulfonic acid; 1-cyclopentyl-7-ethoxy-3-ethyl-4,5-dihydropyrazolo[3,4-c]pyridine Openeye Name: benzenesulfonic acid; 1-cyclopentyl-7-ethoxy-3-ethyl-4,5-dihydropyrazolo[3,4-c]pyridine CAS Name: benzenesulfonic acid; 1-cyclopentyl-7-ethoxy-3-ethyl-4,5-dihydropyrazolo[3,4-c]pyridine IUPAC Name: benzenesulfonic acid; 1-cyclopentyl-7-ethoxy-3-ethyl-4,5-dihydropyrazolo[3,4-c]pyridine Traditional Name: besylic acid; 1-cyclopentyl-7-ethoxy-3-ethyl-4,5-dihydropyrazolo[3,4-c]pyridine Formula: C21H29N3O4S MolecularWeight: 419.53766

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1CCN=C2OCC)C3CCCC3.C1=CC=C(C=C1)S(=O)(=O)O

Isomeric SMILES

CCC1=NN(C2=C1CCN=C2OCC)C3CCCC3.C1=CC=C(C=C1)S(=O)(=O)O

InChI

InChI=1S/C15H23N3O.C6H6O3S/c1-3-13-12-9-10-16-15(19-4-2)14(12)18(17-13)11-7-5-6-8-11;7-10(8,9)6-4-2-1-3-5-6/h11H,3-10H2,1-2H3;1-5H,(H,7,8,9)