[2-[(2-methoxy-4-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-ethylbutanoate

Systemtic Name: [2-[(2-methoxy-4-morpholin-4-ylsulfonyl-phenyl)amino]-2-oxidanylidene-ethyl] 2-ethylbutanoate Openeye Name: [2-(2-methoxy-4-morpholinosulfonyl-anilino)-2-oxo-ethyl] 2-ethylbutanoate CAS Name: 2-ethylbutanoic acid [2-[2-methoxy-4-(4-morpholinylsulfonyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-(2-methoxy-4-morpholin-4-ylsulfonylanilino)-2-oxoethyl] 2-ethylbutanoate Traditional Name: 2-ethylbutyric acid [2-keto-2-(2-methoxy-4-morpholinosulfonyl-anilino)ethyl] ester Formula: C19H28N2O7S MolecularWeight: 428.49982

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C(=O)OCC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)OC

Isomeric SMILES

CCC(CC)C(=O)OCC(=O)NC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)OC

InChI

InChI=1S/C19H28N2O7S/c1-4-14(5-2)19(23)28-13-18(22)20-16-7-6-15(12-17(16)26-3)29(24,25)21-8-10-27-11-9-21/h6-7,12,14H,4-5,8-11,13H2,1-3H3,(H,20,22)