(phenylmethyl) 2-(morpholin-4-ylsulfonylmethyl)-3-phenyl-propanoate

Systemtic Name: (phenylmethyl) 2-(morpholin-4-ylsulfonylmethyl)-3-phenyl-propanoate Openeye Name: benzyl 2-benzyl-3-morpholinosulfonyl-propanoate CAS Name: 2-(4-morpholinylsulfonylmethyl)-3-phenylpropanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-benzyl-3-morpholin-4-ylsulfonylpropanoate Traditional Name: 2-benzyl-3-morpholinosulfonyl-propionic acid benzyl ester Formula: C21H25NO5S MolecularWeight: 403.4919

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)CC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

Isomeric SMILES

C1COCCN1S(=O)(=O)CC(CC2=CC=CC=C2)C(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C21H25NO5S/c23-21(27-16-19-9-5-2-6-10-19)20(15-18-7-3-1-4-8-18)17-28(24,25)22-11-13-26-14-12-22/h1-10,20H,11-17H2