(1-cyanoindolizin-2-yl)methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Openeye Name: (1-cyanoindolizin-2-yl)methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate CAS Name: 4-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzoic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 4-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Traditional Name: 4-(2,6-dimethylmorpholino)sulfonylbenzoic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C23H23N3O5S MolecularWeight: 453.51082

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

Isomeric SMILES

CC1CN(CC(O1)C)S(=O)(=O)C2=CC=C(C=C2)C(=O)OCC3=CN4C=CC=CC4=C3C#N

InChI

InChI=1S/C23H23N3O5S/c1-16-12-26(13-17(2)31-16)32(28,29)20-8-6-18(7-9-20)23(27)30-15-19-14-25-10-4-3-5-22(25)21(19)11-24/h3-10,14,16-17H,12-13,15H2,1-2H3