(phenylmethyl) 5-(4-morpholin-4-ylbutyl)-1H-pyrazole-3-carboxylate

Systemtic Name: (phenylmethyl) 5-(4-morpholin-4-ylbutyl)-1H-pyrazole-3-carboxylate Openeye Name: benzyl 5-(4-morpholinobutyl)-1H-pyrazole-3-carboxylate CAS Name: 5-[4-(4-morpholinyl)butyl]-1H-pyrazole-3-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 5-(4-morpholin-4-ylbutyl)-1H-pyrazole-3-carboxylate Traditional Name: 5-(4-morpholinobutyl)-1H-pyrazole-3-carboxylic acid benzyl ester Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCCC2=CC(=NN2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1COCCN1CCCCC2=CC(=NN2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H25N3O3/c23-19(25-15-16-6-2-1-3-7-16)18-14-17(20-21-18)8-4-5-9-22-10-12-24-13-11-22/h1-3,6-7,14H,4-5,8-13,15H2,(H,20,21)