6-(4-acetyloxybutyl)-1-(4-methoxyphenyl)-7-oxidanylidene-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylic acid

Systemtic Name: 6-(4-acetyloxybutyl)-1-(4-methoxyphenyl)-7-oxidanylidene-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylic acid Openeye Name: 6-(4-acetoxybutyl)-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylic acid CAS Name: 6-(4-acetyloxybutyl)-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylic acid IUPAC Name: 6-(4-acetyloxybutyl)-1-(4-methoxyphenyl)-7-oxo-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylic acid Traditional Name: 6-(4-acetoxybutyl)-7-keto-1-(4-methoxyphenyl)-4,5-dihydropyrazolo[3,4-c]pyridine-3-carboxylic acid Formula: C20H23N3O6 MolecularWeight: 401.41312

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCCCN1CCC2=C(C1=O)N(N=C2C(=O)O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)OCCCCN1CCC2=C(C1=O)N(N=C2C(=O)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H23N3O6/c1-13(24)29-12-4-3-10-22-11-9-16-17(20(26)27)21-23(18(16)19(22)25)14-5-7-15(28-2)8-6-14/h5-8H,3-4,9-12H2,1-2H3,(H,26,27)