3-cyano-5-[(2R,4S,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-yl]-1H-pyrazole-4-carboxylic acid

Systemtic Name: 3-cyano-5-[(2R,4S,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-yl]-1H-pyrazole-4-carboxylic acid Openeye Name: 5-[(2R,4S,5R)-4-benzyloxy-5-(benzyloxymethyl)tetrahydrofuran-2-yl]-3-cyano-1H-pyrazole-4-carboxylic acid CAS Name: 3-cyano-5-[(2R,4S,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)-2-oxolanyl]-1H-pyrazole-4-carboxylic acid IUPAC Name: 3-cyano-5-[(2R,4S,5R)-4-phenylmethoxy-5-(phenylmethoxymethyl)oxolan-2-yl]-1H-pyrazole-4-carboxylic acid Traditional Name: 5-[(2R,4S,5R)-4-benzoxy-5-(benzoxymethyl)tetrahydrofuran-2-yl]-3-cyano-1H-pyrazole-4-carboxylic acid Formula: C24H23N3O5 MolecularWeight: 433.45652

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1C2=C(C(=NN2)C#N)C(=O)O)COCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

C1[C@@H]([C@H](O[C@H]1C2=C(C(=NN2)C#N)C(=O)O)COCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C24H23N3O5/c25-12-18-22(24(28)29)23(27-26-18)20-11-19(31-14-17-9-5-2-6-10-17)21(32-20)15-30-13-16-7-3-1-4-8-16/h1-10,19-21H,11,13-15H2,(H,26,27)(H,28,29)/t19-,20+,21+/m0/s1