(3-morpholin-4-ylsulfonylphenyl)methyl 4-pyrazol-1-ylbenzoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 4-pyrazol-1-ylbenzoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 4-pyrazol-1-ylbenzoate CAS Name: 4-(1-pyrazolyl)benzoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 4-pyrazol-1-ylbenzoate Traditional Name: 4-pyrazol-1-ylbenzoic acid (3-morpholinosulfonylbenzyl) ester Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)C3=CC=C(C=C3)N4C=CC=N4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)C3=CC=C(C=C3)N4C=CC=N4

InChI

InChI=1S/C21H21N3O5S/c25-21(18-5-7-19(8-6-18)24-10-2-9-22-24)29-16-17-3-1-4-20(15-17)30(26,27)23-11-13-28-14-12-23/h1-10,15H,11-14,16H2