[2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-2-ylamino)ethyl] 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Openeye Name: [2-(1-methylbutylamino)-2-oxo-ethyl] 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate CAS Name: 3-[(2,6-dimethyl-4-morpholinyl)sulfonyl]benzoic acid [2-oxo-2-(pentan-2-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-2-ylamino)ethyl] 3-(2,6-dimethylmorpholin-4-yl)sulfonylbenzoate Traditional Name: 3-(2,6-dimethylmorpholino)sulfonylbenzoic acid [2-keto-2-(1-methylbutylamino)ethyl] ester Formula: C20H30N2O6S MolecularWeight: 426.527

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CC(OC(C2)C)C

Isomeric SMILES

CCCC(C)NC(=O)COC(=O)C1=CC(=CC=C1)S(=O)(=O)N2CC(OC(C2)C)C

InChI

InChI=1S/C20H30N2O6S/c1-5-7-14(2)21-19(23)13-27-20(24)17-8-6-9-18(10-17)29(25,26)22-11-15(3)28-16(4)12-22/h6,8-10,14-16H,5,7,11-13H2,1-4H3,(H,21,23)