[2-[(4-morpholin-4-ylsulfonylphenyl)methylamino]-2-oxidanylidene-ethyl] 3,3-dimethylbutanoate

Systemtic Name: [2-[(4-morpholin-4-ylsulfonylphenyl)methylamino]-2-oxidanylidene-ethyl] 3,3-dimethylbutanoate Openeye Name: [2-[(4-morpholinosulfonylphenyl)methylamino]-2-oxo-ethyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [2-[[4-(4-morpholinylsulfonyl)phenyl]methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-morpholin-4-ylsulfonylphenyl)methylamino]-2-oxoethyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [2-keto-2-[(4-morpholinosulfonylbenzyl)amino]ethyl] ester Formula: C19H28N2O6S MolecularWeight: 412.50042

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OCC(=O)NCC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

Isomeric SMILES

CC(C)(C)CC(=O)OCC(=O)NCC1=CC=C(C=C1)S(=O)(=O)N2CCOCC2

InChI

InChI=1S/C19H28N2O6S/c1-19(2,3)12-18(23)27-14-17(22)20-13-15-4-6-16(7-5-15)28(24,25)21-8-10-26-11-9-21/h4-7H,8-14H2,1-3H3,(H,20,22)