(3-morpholin-4-ylsulfonylphenyl)methyl 3-(1-phenylpyrazol-4-yl)propanoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-(1-phenylpyrazol-4-yl)propanoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 3-(1-phenylpyrazol-4-yl)propanoate CAS Name: 3-(1-phenyl-4-pyrazolyl)propanoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-(1-phenylpyrazol-4-yl)propanoate Traditional Name: 3-(1-phenylpyrazol-4-yl)propionic acid (3-morpholinosulfonylbenzyl) ester Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)CCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H25N3O5S/c27-23(10-9-20-16-24-26(17-20)21-6-2-1-3-7-21)31-18-19-5-4-8-22(15-19)32(28,29)25-11-13-30-14-12-25/h1-8,15-17H,9-14,18H2