(3-morpholin-4-ylsulfonylphenyl)methyl 3-(4-dimethylaminophenyl)propanoate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-(4-dimethylaminophenyl)propanoate Openeye Name: (3-morpholinosulfonylphenyl)methyl 3-(4-dimethylaminophenyl)propanoate CAS Name: 3-(4-dimethylaminophenyl)propanoic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 3-(4-dimethylaminophenyl)propanoate Traditional Name: 3-(4-dimethylaminophenyl)propionic acid (3-morpholinosulfonylbenzyl) ester Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CCC(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CCC(=O)OCC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H28N2O5S/c1-23(2)20-9-6-18(7-10-20)8-11-22(25)29-17-19-4-3-5-21(16-19)30(26,27)24-12-14-28-15-13-24/h3-7,9-10,16H,8,11-15,17H2,1-2H3